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기본 정보
- CAS
3213-73-8- 표준 SMILES
CC1CC(CC(=O)O)CC(C)(C)C1- InChIKey
VXUHWUNUVYCREV-UHFFFAOYSA-N- 분자식
- C11H20O2
- 평균 분자량
- 184.27 g/mol
- 단동위원소 질량
- 184.14632988
이름 및 식별자
- 우선 이름
- Cyclohexaneacetic acid, 3,3,5-trimethyl-
- IUPAC
- 2-(3,3,5-trimethylcyclohexyl)acetic acid
- 현지명
- 3,3,5-트리메틸시클로헥산아세트산
- 영어명
- 3,3,5-trimethylcyclohexaneacetic acid
- 분자식
- C11H20O2
- 분자량
- 184.28
이름 및 동의어
Cyclohexaneacetic acid, 3,3,5-trimethyl-3,3,5-Trimethylcyclohexaneacetic acid3,3,5-Trimethylcyclohexylacetic acidEINECS 221-727-1DTXSID70863124RefChem:129549DTXCID60811790221-727-13213-73-82-(3,3,5-trimethylcyclohexyl)acetic acidNN5AQ2R85LSCHEMBL585400
이름 더 보기
3,3,5-트리메틸시클로헥산아세트산3,3,5-trimethylcyclohexane-1-acetic acid
trimethyl cyclohexane acetic acidDAA213733,3,5-trimethyl-cyclohexylacetic acidAKOS009218973(3,3,5-trimethylcyclohexyl)acetic acid2-(3,3,5-trimethylcyclohexyl)aceticacidDB-286317NS00013262
데이터베이스 식별자
- CAS
3213-73-8- PubChem CID
- 102954
- DTXSID
DTXSID70863124- UNII
- NN5AQ2R85L
- EC Number
- 221-727-1
- Nikkaji
- J262.317J
물성
구조 계산 물성보충 중
- XLogP
- 3.4
- 극성 표면적
- 37.3 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 13
- 형식 전하
- 0
- 복잡도
- 196
물리화학적 성질
- 화장품 원료 기능
- 향수
- LogP
- 3.611 · 3.611 (est)
- EPA
- 3 · Cyclohexaneacetic acid, 3,3,5-trimethyl- (3213-73-8)
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 98.9% (89 of 90) of all reports.
Not Classified；Reported as not meeting GHS hazard criteria by 89 of 90 companies (only 1.1% companies provided GHS information). For more detailed information, please visit ECHA C&L website.
Aggregated GHS information provided per 90 reports by companies from 2 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 89 of 90 reports by companies.；There is 1 notification provided by 1 of 90 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 InformationChemical: Cyclohexaneacetic acid, 3,3,5-trimethyl-
Other Safety InformationIMAP assessments - Cyclohexaneacetic acid, 3,3,5-trimethyl-: Environment tier I assessment；IMAP assessments - Cyclohexaneacetic acid, 3,3,5-trimethyl-: Human health tier I assessment
Hazard Classes and CategoriesNot Classified
규제 정보
Regulatory InformationChemical: Cyclohexaneacetic acid, 3,3,5-trimethyl-
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
Use ClassificationFragrance Ingredients
General Manufacturing InformationCyclohexaneacetic acid, 3,3,5-trimethyl-: ACTIVE
공급사1 곳
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
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