기본 정보
- CAS
23747-43-5- 표준 SMILES
CCOC(=O)C(C)SSC- InChIKey
DZOQRCWJNNRVPT-UHFFFAOYSA-N- 분자식
- C6H12O2S2
- 평균 분자량
- 180.3 g/mol
- 단동위원소 질량
- 180.02787197
개요
Ethyl 2-(methyldithio)propionate is a carboxylic ester.
이름 및 식별자
- 우선 이름
- Ethyl 2-(methyldithio)propionate
- IUPAC
- ethyl 2-(methyldisulfanyl)propanoate
- 영어명
- ETHYL 2-(METHYLDITHIO)PROPIONATE
- 분자식
- C6H12O2S2
- 분자량
- 180.29
이름 및 동의어
Ethyl 2-(methyldithio)propionate23747-43-5ethyl 2-(methyldisulfanyl)propanoatePropanoic acid, 2-(methyldithio)-, ethyl esterethyl 2-(methyl dithio) propionateLTB6AT933DEINECS 245-862-0FEMA NO. 3834DTXSID80865114ETHYL 2-(METHYLDITHIO)PROPIONATE [FHFI]PROPIONIC ACID, 2-(METHYLDITHIO)-, ETHYL ESTERRefChem:594021
이름 더 보기
ETHYL 2-(METHYLDITHIO)PROPIONATE, 98+%2-(methyldithio)-propanoicaciethylester2-(Methyldithio)propionic acid ethyl esterethyl 2-(methyl dithio) propionate USP/EP/BP
DTXCID50813561245-862-0UNII-LTB6AT933DSCHEMBL1532548FEMA 3834CHEBI:178972DZOQRCWJNNRVPT-UHFFFAOYSA-Nethyl2-(methyldisulfanyl)propanoate
데이터베이스 식별자
- CAS
23747-43-5- PubChem CID
- 90972
- DTXSID
DTXSID80865114- ChEBI
CHEBI:178972- UNII
- LTB6AT933D
물성
구조 계산 물성
- XLogP
- 1.6
- 극성 표면적
- 76.9 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 10
- 형식 전하
- 0
- 복잡도
- 106
실험 및 물리화학적 성질
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density1.090-1.120
Flavoring AgentsEU Flavoring substances
Solubility
very slightly
very slightly soluble in water; soluble in alcohols and oils
(in ethanol)
Boiling Point
105.00 °C. @ 12.00 mm Hg
105 °C (12 mm Hg)
Refractive Index1.490-1.500
Physical Descriptioncolourless to pale yellow liquid
물리화학적 성질
- 끓는 점
- 105 °C · 105 °C (12 mmHg)
- 밀도
- 1.12 · 1.12
- 굴절률
- 1.499 · 1.499-1.501
- FEMA
- 3834 · 3834 | ETHYL 2-(METHYLDITHIO)PROPIONATE
- 인화점
- 89 °C · 89 °C
- 냄새
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (234 of 234) of all reports.
Not Classified
Aggregated GHS information provided per 234 reports by companies from 1 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory InformationPropanoic acid, 2-(methyldithio)-, ethyl ester: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesNot Classified
안전 데이터
- tsca
- TSCA listed
- safety_code
- 24/25
화학 및 산업
약리 정보
Cellular LocationsCytoplasm
용도 및 제조
Use Classification
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index
General Manufacturing InformationPropanoic acid, 2-(methyldithio)-, ethyl ester: INACTIVE
공급사5 곳
BOC Sciences[email protected]
career henan chemical co+86-0371-86658258 · [email protected]
上海问彩新材料科技有限公司15721586846 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]
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