Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
디메틸벤질아민
N,N-다이메틸벤질아민 · 디메틸벤질아민 · 벤질다이메틸아민 · 벤질디메틸아민 · N,N-디메틸벤질아민 · BDMA · N,N-DiMethyl-1-phenylMethanaMine · Benzyldimethylamine
식별자 및 물리적 특성
| CAS No. | 103-83-3 |
|---|---|
| 분자식 | C9H13N |
| 평균 분자량 | 135.21 g/mol |
| 단동위원소 질량 | 135.10479942 g/mol |
| SMILES | CN(C)Cc1ccccc1 |
| InChIKey | XXBDWLFCJWSEKW-UHFFFAOYSA-N |
| PubChem CID | 7681 |
| ChEMBL | CHEMBL45591 |
| ChEBI | CHEBI:231275 |
| EC No. | 203-149-1 |
| DTXSID | DTXSID8021854 |
| 현지명 | 디메틸벤질아민 |
화학 및 물리적 성질
| XLogP | 2 |
|---|---|
| 극성 표면적 | 3.2 |
| 수소 결합 공여자 수 | 0 |
| 수소 결합 수용자 수 | 1 |
| 회전 가능 결합 수 | 2 |
| 무거운 원자 수 | 10 |
| 형식 전하 | 0 |
| 복잡도 | 82 |
| LogP(분배 계수) | 1.91 |
| 밀도 | 0.915 at 50 °F (USCG, 1999) - Less dense than waterwill floatRelative density (water = 1): 0.90.915 @ 10°C0.9 g/mL at 25 °C(lit.) |
| 용해도 | Solubility in water, g/100ml: 1.2 (moderate)물에 용해 |
| 인화점 | 140 °F57 °C o.c.130 °F |
| 끓는 점 | 357.8 °F at 760 mmHg (USCG, 1999)180 °C181 °C @760 [mm Hg]183-184 °C765 mm Hg(lit.) |
| 녹는점 | -103 °F (USCG, 1999)-75 °C |
| 증기압 | 0.58 [mmHg]2.4 hPa (20 °C) |
| Physical Description | Benzyldimethylamine appears as a colorless to light yellow liquid with an aromatic odor. Slightly less dense than water and slightly soluble in water. Corrosive to skin, eyes and mucous membranes. Slightly toxic by ingestion, skin absorption and inhalation. Used in the manufacture of adhesives and other chemicals.Clear to yellow liquid with a strong odor[NJ-HSFS]COLOURLESS LIQUID WITH CHARACTERISTIC ODOUR. |
| Kovats Retention Index | 1017.91025.51350 |
| 굴절률 | n20/D 1.501(lit.) |
| 저장 조건 | Store below +30°C. |
| pKa(산도 계수) | pK1:9.02(+1) (25°C) |
| 물리적 상태 | 액체 |
| 색상 | 무색투명~연황색 |
| pH | 10 (10g/l, H2O, 20℃)(saturated solution) |
| 냄새 | 강한 생선 냄새 |
| 폭발한계 | 0.9-6.3%(V) |
| 용해도 | 8g/L(20℃) |
| BRN | 1099620 |
| 안정성 | 안정적인. 강산, 강산화제와 호환되지 않습니다. |
| InChI | 1S/C9H13N/c1-10(2)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3 |
| InChIKey | XXBDWLFCJWSEKW-UHFFFAOYSA-N |
| SMILES | CN(C)Cc1ccccc1 |
| LogP(분배 계수) | 1.98 at 25℃ |
| NIST | Benzenemethanamine, N,N-dimethyl-(103-83-3) |
| EPA | N,N-Dimethylbenzylamine (103-83-3) |
화학적 성질
Colorless to light yellow flammable liquid with ammonia odor. Soluble in ethanol, ether, insoluble in water.
안전 및 규제
| GHS 분류 | DangerH226: Flammable liquid and vapor [Warning Flammable liquids]H302: Harmful if swallowed [Warning Acute toxicity, oral]H312: Harmful in contact with skin [Warning Acute toxicity, dermal]H314: Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]H332: Harmful if inhaled [Warning Acute toxicity, inhalation]H412: Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P271, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)This chemical does not meet GHS hazard criteria for 0.1% (1 of 850) of reports. |
|---|---|
| 규제 정보 | Chemical: Benzenemethanamine, N,N-dimethyl-Benzenemethanamine, N,N-dimethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenemethanamine, N,N-dimethyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)Status: Active Update: 18-04-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/13869Benzyldimethylamine: Does not have an individual approval but may be used under an appropriate group standardThe New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.) |
| 기타 안전 정보 | Evaluation - Chemicals that are unlikely to require further regulation to manage risks to human health |
| 운송 라벨(DOT) | Corrosive Flammable Liquid |
| 화재 위험 | Special Hazards of Combustion Products: Toxic vapors are generated when heated. (USCG, 1999)· Flammable/combustible material.· May be ignited by heat, sparks or flames.· Vapors may form explosive mixtures with air.· Vapors may travel to source of ignition and flash back.· Most vapors are heavier than air. They will spread along the ground and collect in low or confined areas (sewers, basements, tanks, etc.).· Vapor explosion hazard indoors, outdoors or in sewers.· Those substances designated with a (P) may polymerize explosively when heated or involved in a fire.· Runoff to sewer may create fire or explosion hazard.· Containers may explode when heated.· Many liquids will float on water.Flammable. Gives off irritating or toxic fumes (or gases) in a fire. Above 57 °C explosive vapour/air mixtures may be formed. |
| 건강 유해성 | Inhalation may be fatal as a result of spasm, inflammation and edema of the larynx and bronchi, chemical pneumonitis, and pulmonary edema. Symptoms of exposure may include burning sensation, coughing, wheezing, laryngitis, shortness of breath, headache, nausea, and vomitting. (USCG, 1999)· May cause toxic effects if inhaled or ingested.· Contact with substance may cause severe burns to skin and eyes.· Fire will produce irritating, corrosive and/or toxic gases.· Vapors may cause dizziness or asphyxiation, especially when in closed or confined areas.· Runoff from fire control or dilution water may cause environmental contamination. |
| 유해성 요약 | Corrosive to skin[Quick CPC] A corrosive substance that can cause pulmonary edema[ICSC] |
| 운송 번호 및 가이드(DOT) | 2619 132 |
| 반응성 그룹 | Amines, Phosphines, and Pyridines |
| EC 분류 | Symbol: CR: 10-20/21/22-34-52/53S: (1/2)-26-36-45-61 |
| UN 분류 | UN Hazard Class: 8UN Subsidiary Risks: 3UN Pack Group: II |
| Reactivity Profile | BENZYLDIMETHYLAMINE neutralizes acids on exothermic reactions to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen is generated by amines in combination with strong reducing agents, such as hydrides. May attack some plastics (USCG, 1999). |
| Chemical Dangers | Decomposes on burning. This produces toxic fumes including nitrogen oxides. Reacts with acids. Reacts violently with strong oxidants. |
| 소화 | Excerpt from ERG Guide 132 [Flammable Liquids - Corrosive]:Some of these materials may react violently with water.SMALL FIRE: Dry chemical, CO2, water spray or alcohol-resistant foam.LARGE FIRE: Water spray, fog or alcohol-resistant foam. If it can be done safely, move undamaged containers away from the area around the fire. Dike runoff from fire control for later disposal. Do not get water inside containers.FIRE INVOLVING TANKS, RAIL TANK CARS OR HIGHWAY TANKS: Fight fire from maximum distance or use unmanned master stream devices or monitor nozzles. Cool containers with flooding quantities of water until well after fire is out. Withdraw immediately in case of rising sound from venting safety devices or discoloration of tank. ALWAYS stay away from tanks in direct contact with flames. For massive fire, use unmanned master stream devices or monitor nozzlesif this is impossible, withdraw from area and let fire burn. (ERG, 2024)Use water spray, powder, alcohol-resistant foam, carbon dioxide. In case of fire: keep drums, etc., cool by spraying with water. |
| 응급 조치 | Fresh air, rest. Half-upright position. Artificial respiration may be needed. Refer for medical attention.Remove contaminated clothes. Rinse skin with plenty of water or shower. Refer for medical attention .First rinse with plenty of water for several minutes (remove contact lenses if easily possible), then refer for medical attention.Rinse mouth. Do NOT induce vomiting. Refer for medical attention . |
| 누출 비상 조치 | · CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.· Keep unauthorized personnel away.· Stay upwind, uphill and/or upstream.· Ventilate closed spaces before entering, but only if properly trained and equipped.· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.· All equipment used when handling the product must be grounded.· Do not touch or walk through spilled material.· Stop leak if you can do it without risk.· Prevent entry into waterways, sewers, basements or confined areas.· A vapor-suppressing foam may be used to reduce vapors.· Absorb with earth, sand or other non-combustible material.· For hydrazine, absorb with DRY sand or inert absorbent (vermiculite or absorbent pads).· Use clean, non-sparking tools to collect absorbed material.Large Spill· Dike far ahead of liquid spill for later disposal.· Water spray may reduce vapor, but may not prevent ignition in closed spaces. |
| 응급 처치 | INHALATION: Remove victim to fresh air and call a physician at onceadminister oxygen until physician arrives.INGESTION: Get medical attention at once.EYES or SKIN: Flush with plenty of water for at least 15 minif cyanosis is present, shower with soap and warm water, with special attention to scalp and finger nailsremove any contaminated clothing. (USCG, 1999)General First Aid:· Call 911 or emergency medical service.· Ensure that medical personnel are aware of the material(s) involved, take precautions to protect themselves and avoid contamination.· Move victim to fresh air if it can be done safely.· Administer oxygen if breathing is difficult.· If victim is not breathing:-- DO NOT perform mouth-to-mouth resuscitationthe victim may have ingested or inhaled the substance.-- If equipped and pulse detected, wash face and mouth, then give artificial respiration using a proper respiratory medical device (bag-valve mask, pocket mask equipped with a one-way valve or other device).-- If no pulse detected or no respiratory medical device available, provide continuous compressions. Conduct a pulse check every two minutes or monitor for any signs of spontaneous respirations.· Remove and isolate contaminated clothing and shoes.· For minor skin contact, avoid spreading material on unaffected skin.· In case of contact with substance, remove immediately by flushing skin or eyes with running water for at least 20 minutes.· For severe burns, immediate medical attention is required.· Effects of exposure (inhalation, ingestion, or skin contact) to substance may be delayed.· Keep victim calm and warm.· Keep victim under observation.· For further assistance, contact your local Poison Control Center.· Note: Basic Life Support (BLS) and Advanced Life Support (ALS) should be done by trained professionals.Specific First Aid:· For corrosives, in case of contact, immediately flush skin or eyes with running water for at least 30 minutes. Additional flushing may be required. |
| 안전 보관 | Fireproof. Separated from strong oxidants, strong acids and food and feedstuffs. |
| 노출 관리 및 개인 보호 | · Wear positive pressure self-contained breathing apparatus (SCBA).· Wear chemical protective clothing that is specifically recommended by the manufacturer when there is NO RISK OF FIRE.· Structural firefighters' protective clothing provides thermal protection but only limited chemical protection. |
| 비화재 누출 대응 | Excerpt from ERG Guide 132 [Flammable Liquids - Corrosive]:ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area. All equipment used when handling the product must be grounded. Do not touch or walk through spilled material. Stop leak if you can do it without risk. Prevent entry into waterways, sewers, basements or confined areas. A vapor-suppressing foam may be used to reduce vapors. Absorb with earth, sand or other non-combustible material. For hydrazine, absorb with DRY sand or inert absorbent (vermiculite or absorbent pads). Use clean, non-sparking tools to collect absorbed material.LARGE SPILL: Dike far ahead of liquid spill for later disposal. Water spray may reduce vapor, but may not prevent ignition in closed spaces. (ERG, 2024) |
| 누출 처리 | Personal protection: complete protective clothing including self-contained breathing apparatus. Do NOT let this chemical enter the environment. Collect leaking and spilled liquid in sealable containers as far as possible. Cautiously neutralize remainder. Then wash away with plenty of water. |
| Isolation and Evacuation | Excerpt from ERG Guide 132 [Flammable Liquids - Corrosive]:IMMEDIATE PRECAUTIONARY MEASURE: Isolate spill or leak area for at least 50 meters (150 feet) in all directions.SPILL: Increase the immediate precautionary measure distance, in the downwind direction, as necessary.FIRE: If tank, rail tank car or highway tank is involved in a fire, ISOLATE for 800 meters (1/2 mile) in all directionsalso, consider initial evacuation for 800 meters (1/2 mile) in all directions. (ERG, 2024)Immediate precautionary measure· Isolate spill or leak area for at least 50 meters (150 feet) in all directions.· For highlighted materials: see Table 1 - Initial Isolation and Protective Action Distances.· For non-highlighted materials: increase the immediate precautionary measure distance, in the downwind direction, as necessary.· If tank, rail tank car or highway tank is involved in a fire, ISOLATE for 800 meters (1/2 mile) in all directionsalso, consider initial evacuation for 800 meters (1/2 mile) in all directions. |
| Eye Prevention | Wear face shield. |
| Fire Prevention | NO open flames, NO sparks and NO smoking. Above 57 °C use a closed system, ventilation and explosion-proof electrical equipment. |
| Inhalation Risk | No indication can be given about the rate at which a harmful concentration of this substance in the air is reached on evaporation at 20 °C. |
| 유해 작용 | Dermatotoxin - Skin burns.Toxic Pneumonitis - Inflammation of the lungs induced by inhalation of metal fumes or toxic gases and vapors. |
| 노출 경로 | The substance can be absorbed into the body by inhalation of its vapour, through the skin and by ingestion. |
| Signs and Symptoms | Sore throat. Cough. Burning sensation. Shortness of breath. Laboured breathing. Symptoms may be delayed.Pain. Redness. Blisters. Skin burns.Pain. Redness. Severe deep burns.Burning sensation. Abdominal pain. Shock or collapse. |
| ICSC Environmental Data | The substance is harmful to aquatic organisms. |
| Toxicity Data | LCLo (rat) = 1,200 mg/m3/2H |
| 수질 위해 등급(WGK) | 2 |
| TSCA 등재 상태 | TSCA listed |
| RTECS 번호 | DP4500000 |
| 운송 번호(UN) | UN 2619 |
| 독성 | LD50 orally in Rabbit: 290 mg/kg LD50 dermal Rat 695 mg/kg |
| 관세 코드 | 29214980 |
| 위험 문구(R) | 10-20/21/22-34-52/53 |
| 위험 표시 | C |
| 안전 문구(S) | 26-36-45-61 |
| 포장분류 | II |
| 위험 등급 | 8Acute Tox. 3 InhalationAcute Tox. 3 OralAcute Tox. 4 DermalAquatic Chronic 2Eye Dam. 1Flam. Liq. 3Skin Corr. 1B |
| 기존화학 물질 | KE-11221 |
| F 고인화성물질 | 10-13-23 |
| 자연 발화 온도 | 410 °C |
| 저장 분류 | 3 - Flammable liquids |
용도
용도
N,N-Dimethylbenzylamine was used in the synthesis of bis[(N,N-dimethylamino)benzyl] selenide. It has been used as catalyst during curing reaction of formulations of diglycidyl ether of bisphenol A and tetrahydrophthalic anhydride. It undergoes directed ortho metalation with butyl lithium. It reacts with methyl iodide to get ammonium salt, which is used as phase transfer catalysts. Further, it is used as a catalyst for the formation of polyurethane foams and epoxy resins.
일반 설명
Benzyldimethylamine appears as a colorless to light yellow liquid with an aromatic odor. Slightly less dense than water and slightly soluble in water. Corrosive to skin, eyes and mucous membranes. Slightly toxic by ingestion, skin absorption and inhalation. Used in the manufacture of adhesives; dehydrohalogenating catalyst; corrosion inhibitor; acid neutralizer; potting compounds; cellulose modifier and quaternary ammonium compounds.
제조 및 합성 방법
제조 방법
25% Aqueous Dimethylamine, 1088 grams Benzyl Chloride, 126.6 grams In the apparatus of Example 1, the benzyl chloride was added dropwise over a two-hour period to the amine (molar ratio 1 to 6) at a rate sufficient to maintain the temperature below 40°C. Stirring was continued at room temperature for an additional hour to insure completion of the reaction denoted by the equation below. Thereafter the reaction mixture was cooled in a separatory funnel while standing in a refrigerator maintained at 5° C. and separated into two layers. The upper oily layer, weighing 111.5g, was removed and steam distilled until no further oleaginous component was observed in the distillate as it came over. The crude distillate was found to contain 103.5g of N,N-dimethylbenzylamine (76.1% of theory), 3.3g of dimethylamine and no quaternary salts. The dimethylamine was distilled off below 29°C under atmospheric pressure from the N,N-dimethylbenzylamine (bp 82°C/18mmHg).