기본 정보
- CAS
6624-71-1- 표준 SMILES
CCCCCCCCCCCCOC(=O)C(C)C- InChIKey
LDPLLPONRGVDGK-UHFFFAOYSA-N- 분자식
- C16H32O2
- 평균 분자량
- 256.42 g/mol
- 단동위원소 질량
- 256.24023026
이름 및 식별자
- 우선 이름
- Dodecyl isobutyrate
- IUPAC
- dodecyl 2-methylpropanoate
- 영어명
- DODECYL ISOBUTYRATE
- 분자식
- C16H32O2
- 분자량
- 256.42
이름 및 동의어
Dodecyl isobutyrateDodecyl 2-methylpropanoateLauryl isobutyratePropanoic acid, 2-methyl-, dodecyl esterIsobutyric acid, dodecyl esterLauryl 2-methylpropanoateFEMA No. 3452UNII-02470X34WDEINECS 229-583-1NSC 5382302470X34WDNSC-53823
이름 더 보기
FEMA 3452odecyl2-methylpropanoateDODECYL ISOBUTYRATE USP/EP/BP2-methyl-propanoicacidodecylester2-Methylpropionic acid dodecyl esterPropanoicacid,2-methyl-,dodecylester2-methyl-propanoic acid dodecyl ester
DTXSID4064424DODECYL ISOBUTYRATE [FHFI]Isobutyric acid, dodecyl ester (8CI)RefChem:135499DTXCID6044775229-583-1LDPLLPONRGVDGK-UHFFFAOYSA-N6624-71-1
데이터베이스 식별자
- CAS
6624-71-1- PubChem CID
- 243691
- DTXSID
DTXSID4064424- ChEBI
CHEBI:174372- UNII
- 02470X34WD
- EC Number
- 229-583-1
- Nikkaji
- J225.220A
물성
구조 계산 물성
- XLogP
- 6.6
- 극성 표면적
- 26.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 13
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 188
실험 및 물리화학적 성질
Density0.854-0.860 (20 °C/20 °C)
Solubility
soluble in organic solvents; insoluble inwater
(in ethanol)
Boiling Point
299.00 °C. @ 760.00 mm Hg
299 °C
Refractive Index1.432-1.436
Physical Descriptionliquid/slightly fruity or practically odourless
물리화학적 성질
- 녹는점
- -36 °C · -36°C (estimate)
- 끓는 점
- 299.67 °C · 299.67°C (estimate)
- 밀도
- 0.864 · 0.864
- 굴절률
- 1.434 · 1.4340
- FEMA
- 3452 · 3452 | DODECYL ISOBUTYRATE
- 저장 조건
- Sealed in dry,Room Temperature
- 물리적 상태
- Colorless oily liquid
- 냄새
- 100 %에서 · 100.00%에서. 희미한 기름진 지방 과일 향
- 냄새 유형
- 과일 같은
- JECFA Number
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (89 of 89) of all reports.
Not Classified；Reported as not meeting GHS hazard criteria by 89 of 89 companies. For more detailed information, please visit ECHA C&L website.
Aggregated GHS information provided per 89 reports by companies from 1 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 89 of 89 reports by companies.；There are 0 notifications provided by 0 of 89 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
유해성 정보
Regulatory Information
Chemical: Propanoic acid, 2-methyl-, dodecyl ester
Propanoic acid, 2-methyl-, dodecyl ester: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazard Classes and CategoriesNot Classified
규제 정보
Regulatory Information
Chemical: Propanoic acid, 2-methyl-, dodecyl ester
Propanoic acid, 2-methyl-, dodecyl ester: Does not have an individual approval but may be used under an appropriate group standard
안전 데이터
- tsca
- TSCA listed
화학 및 산업
약리 정보
Cellular LocationsExtracellular；Membrane
용도 및 제조
Use Classification
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index
General Manufacturing InformationPropanoic acid, 2-methyl-, dodecyl ester: INACTIVE
응용 분야
용도Could find a little use in perfumery in certain floral bases, in Ambre-like topnotes, as a support to winey-floral-musky topnotes, etc.
공급사28 곳
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
관련 반응
2건
화합물 노트
불러오는 중…