Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
에피네프린
에피네프린 · DL-아드레날린 · RACEPINEPHRINE · (R)-4-(1-hydroxy-2-(methylamino)ethyl)benzene-1,2-diol · DL-ADRENALINE · DL-EPINEPHRINE · Epinehrine · DL-Adrenali
식별자 및 물리적 특성
| CAS No. | 329-65-7 |
|---|---|
| 분자식 | C9H13NO3 |
| 평균 분자량 | 183.2 g/mol |
| 단동위원소 질량 | 183.08954328 g/mol |
| SMILES | CNCC(O)c1ccc(O)c(O)c1 |
| InChIKey | UCTWMZQNUQWSLP-UHFFFAOYSA-N |
| PubChem CID | 838 |
| ChEMBL | CHEMBL1740 |
| ChEBI | CHEBI:33568 |
| EC No. | 206-347-6 |
| DTXSID | DTXSID80858965 |
| 현지명 | 에피네프린 |
화학 및 물리적 성질
| XLogP | -1.4 |
|---|---|
| 극성 표면적 | 72.7 |
| 수소 결합 공여자 수 | 4 |
| 수소 결합 수용자 수 | 4 |
| 회전 가능 결합 수 | 3 |
| 무거운 원자 수 | 13 |
| 형식 전하 | 0 |
| 복잡도 | 154 |
| 용해도 | Sparingly soluble (NTP, 1992)0.1 M HCL : 2.5 mg/mL (13.65 mMultrasonic and adjust pH to 1 with HCl)DMSO : 1 mg/mL (5.46 mMultrasonic and adjust pH to 7 with HCl)Ethanol : < 1 mg/mL (insoluble)H2O : < 0.1 mg/mL (insoluble) |
| 녹는점 | 412 to 414 °F (NTP, 1992)197 °C (dec.)(lit.) |
| Physical Description | 3,4-dihydroxyl-alpha-[methylamino]methylbenzyl alcohol appears as odorless light brown or nearly white crystals. (NTP, 1992) |
| 끓는 점 | 316.88°C (rough estimate) |
| 밀도 | 1.1967 (rough estimate) |
| 굴절률 | 1.4760 (estimate) |
| 저장 조건 | 2-8°C |
| pKa(산도 계수) | 9.60±0.10(Predicted) |
| 물리적 상태 | 가루 |
| 용해도 | 난용성 |
| Merck | 14,3619 |
| InChI | InChI=1S/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3 |
| InChIKey | UCTWMZQNUQWSLP-UHFFFAOYSA-N |
| SMILES | C1(O)=CC=C(C(O)CNC)C=C1O |
| EPA | 4-[1-Hydroxy-2-(methylamino)ethyl]-1,2-benzenediol (329-65-7) |
화학적 성질
Solid
안전 및 규제
| GHS 분류 | DangerH311 (97.6%): Toxic in contact with skin [Danger Acute toxicity, dermal]P261, P262, P264, P264+P265, P270, P271, P280, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| 운송 라벨(DOT) | Poison |
| 화재 위험 | Flash point data for this compound are not available, however, it is probably combustible. (NTP, 1992) |
| 건강 유해성 | SYMPTOMS: Pallor, tremor, anxiety, nervousness, rapid, forceful pulse, rise in blood pressure and temperature, rapid breathing, dilation of the pupils. (NTP, 1992) |
| 반응성 그룹 | Amines, Phosphines, and Pyridines |
| Reactivity Profile | Light sensitive. Incompatible with heat, air, iron salts, and alkalis. (NTP, 1992). An organic compound with both amine and alcohol substituents. Amines are chemical bases. They neutralize acids to form salts plus water. These acid-base reactions are exothermic. The amount of heat that is evolved per mole of amine in a neutralization is largely independent of the strength of the amine as a base. Amines 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. Incompatible with heat, air, iron salts, and alkalis. (NTP, 1992). |
| Air and Water Reactions | Slightly water soluble (NTP, 1992). |
| Hazard Classes and Categories | Acute Tox. 3 (97.6%) |
| 소화 | Fires involving this material can be controlled with a dry chemical, carbon dioxide, foam, or Halon extiguisher. (NTP, 1992) |
| 응급 처치 | EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop. |
| 비화재 누출 대응 | SMALL SPILLS AND LEAKAGE: If you spill this chemical, you should dampen the solid spill material with 5% acetic acid, then transfer the dampened material to a suitable container. Use absorbent paper dampened with 5% acetic acid to pick up any remaining material. Your contaminated clothing and the absorbent paper should be sealed in a vapor-tight plastic bag for eventual disposal. Wash all contaminated surfaces with 5% acetic acid followed by washing with a strong soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned. |
| Isolation and Evacuation | Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]: |
| Personal Protective Equipment (PPE) | RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with a combination filter cartridge, i.e. organic vapor/acid gas/HEPA (specific for organic vapors, HCl, acid gas, SO2 and a high efficiency particulate filter). (NTP, 1992) |
| 수질 위해 등급(WGK) | 3 |
| RTECS 번호 | DO2975000 |
| 운송 번호(UN) | UN 2811 6.1/PG 2 |
| 위험 문구(R) | 24-36/37/38 |
| 위험 표시 | T |
| 안전 문구(S) | 26-36/37-45 |
| 포장분류 | III |
| 위험 등급 | 6.1(b) |
용도
용도
DL-Adrenaline is a hormone and a neurotransmitter secreted by the medulla of the adrenal glands. In medicine DL-Adrenaline is used chiefly as a stimulant in cardiac arrest, as a vasoconstrictor in shock, and as a bronchodilator and antispasmodic in bronch
일반 설명
Odorless light brown or nearly white crystals.