디에틸아미노에탄올
다이에틸아미노에탄올 · 2-디에틸아미노에탄올 · 다이에틸아미노에탄올(디에틸아미노에탄올) · 디에틸아미노에탄올 · 다이에틸에탄올아민 · DEAE · DEEA · DIETHYLETHANOLAMINE

식별자 및 물리적 특성
| CAS No. | 100-37-8 |
|---|---|
| 분자식 | C6H15NO |
| 평균 분자량 | 117.19 g/mol |
| 단동위원소 질량 | 117.1153641 g/mol |
| SMILES | CCN(CC)CCO |
| InChIKey | BFSVOASYOCHEOV-UHFFFAOYSA-N |
| PubChem CID | 7497 |
| ChEMBL | CHEMBL1183 |
| ChEBI | CHEBI:52153 |
| EC No. | 202-845-2 |
| DTXSID | DTXSID5021837 |
| 현지명 | 디에틸아미노에탄올 |
화학 및 물리적 성질
| XLogP | 0.3 |
|---|---|
| 극성 표면적 | 23.5 |
| 수소 결합 공여자 수 | 1 |
| 수소 결합 수용자 수 | 2 |
| 회전 가능 결합 수 | 4 |
| 무거운 원자 수 | 8 |
| 형식 전하 | 0 |
| 복잡도 | 43.8 |
| 물질 분류 | Nitrogen Compounds -> EthanolaminesFlammable agents - 2nd degreeIndustrial compound |
| SpringerMaterials Properties | Boiling point |
| LogP(분배 계수) | 0.46 |
| 냄새 | NAUSEATING ODORNauseating, ammonia-like odor.특유의 암모니아 냄새 |
| 식품 첨가물 | BOILER WATER ADDITIVE -> FDA Substance added to food |
| 밀도 | 0.8921 at 77 °F (USCG, 1999) - Less dense than waterwill float0.8921 @ 20 °C/4 °CRelative density (water = 1): 0.880.8851 @ 20°C0.884 g/mL at 25 °C (lit.) |
| Viscosity | 5 mPa-s at 20 °C |
| Color/Form | COLORLESS LIQUIDColorless liquid. |
| 용해도 | Very soluble (NTP, 1992)SOL IN ALL PROPORTIONS IN WATERSOL IN ALC, ETHER, ACETONE, BENZENE, PETROLEUM ETHER1000000 mg/L @ 25 °C (exp)Solubility in water: miscible쉽게 용해됨 |
| 인화점 | 140 °F (NTP, 1992)49 °C140 °F (OPEN CUP)125 °F (closed cup)52 °C c.c.120 °F |
| 끓는 점 | 325 °F at 760 mmHg (NTP, 1992)163 °C @ 760 MM HG163.00 °C. @ 760.00 mm Hg162 °C @760 [mm Hg]161 °C (lit.) |
| Decomposition | When heated to decomposition it emits toxic fumes of /nitrogen oxides/. |
| 녹는점 | -70 °C |
| 증기 밀도 | 4.04 (vs air) |
| 증기압 | 1 mm Hg ( 20 °C) |
| 굴절률 | n20/D 1.441(lit.) |
| 저장 조건 | Store below +30°C. |
| 물리적 상태 | 결정성 분말 |
| pKa(산도 계수) | 14.74±0.10(Predicted) |
| 색상 | 흰색에서 연한 노란색 |
| pH | 11.5 (100g/l, H2O, 20℃) |
| 폭발한계 | 0.7%(V) |
| 용해도 | 녹는 |
| Merck | 14,3112 |
| BRN | 741863 |
| 헨리 상수 | 5.9×100 mol/(m3Pa) at 25℃, Du et al. (2017) |
| 안정성 | 안정적인. 가연성. 강한 산화제, 산과 호환되지 않습니다. 수분에 민감합니다. 흡습성. |
| 화장품 원료 기능 | 버퍼링 |
| InChI | 1S/C6H15NO/c1-3-7(4-2)5-6-8/h8H,3-6H2,1-2H3 |
| InChIKey | BFSVOASYOCHEOV-UHFFFAOYSA-N |
| SMILES | N(CCO)(CC)CC |
| LogP(분배 계수) | 0.21 at 23℃ |
| 표면장력 | 27.99mN/m at 293.15K |
| NIST | Ethanol, 2-(diethylamino)-(100-37-8) |
| EPA | Diethylaminoethanol (100-37-8) |
화학적 성질
Colorless liquid with a nauseating, weak, ammonia odor; hygroscopic; very soluble in water; soluble in alcohol, ether acetone, benzene, and petroleum ether.
안전 및 규제
| GHS 분류 | DangerH226: Flammable liquid and vapor [Warning Flammable liquids]P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P271, 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)H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]P210, P233, P234, P240, P241, P242, P243, P260, P261, P262, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P361+P364, P362+P364, P363, P370+P378, P390, P403+P233, P403+P235, P405, P406, and P501 (click each P-code to see the statement) |
|---|---|
| 규제 정보 | Chemical: Ethanol, 2-(diethylamino)-Ethanol, 2-(diethylamino)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Ethanol, 2-(diethylamino)- 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: 10-11-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/21342-Diethylaminoethanol: 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 | IMAP assessments - Ethanol, 2-(diethylamino)-: Human health tier II assessment |
| 운송 라벨(DOT) | Corrosive Flammable Liquid |
| 화재 위험 | Special Hazards of Combustion Products: Toxic and irritating gases may be generated.· Flammable/combustible material.Flammable. Gives off irritating or toxic fumes (or gases) in a fire. Above 52 °C explosive vapour/air mixtures may be formed. |
| 화재 가능성 | Flammablemoderate fire hazard |
| 건강 유해성 | INHALATION: Irritation of mucous membranes. EYES: Corrosive, causes intense pain. SKIN: Severe irritation. May cause allergic skin reaction. INGESTION: Gastrointestinal irritation. (USCG, 1999) |
용도
용도
Water-soluble salts; textile softeners; antirust formulations; fatty acid derivatives; pharmaceuticals; curing agent for resins; emulsifying agents in acid media; organic synthesis.
일반 설명
A colorless liquid. Flash point 103-140°F. Less dense than water . Vapors heavier than air. Produces toxic oxides of nitrogen during combustion. Causes burns to the skin, eyes and mucous membranes.
제조 및 합성 방법
생산 방법
2-Diethylaminoethanol (DEAE) is a tertiary amine produced by reaction of ethylene oxide or ethylene chlorhydrin and diethylamine (RTECS 1988). Itokazu (1987) has modified this process for manufacture of DEAE without eventual discoloration. Production in this country exceeds 2866 pounds per year (HSDB 1988).