기본 정보
- CAS
3526-75-8- 표준 SMILES
CC1CCC(C(C)(C)O)CC2C(C)CCC12- InChIKey
PAFKTNNJJBQVBA-UHFFFAOYSA-N- 분자식
- C15H28O
- 평균 분자량
- 224.38 g/mol
- 단동위원소 질량
- 224.21401551
개요
See other relationships...
이름 및 식별자
- 우선 이름
- 5-Azulenemethanol, decahydro-alpha,alpha,3,8-tetramethyl-, (3S-(3alpha,3abeta,5alpha,8alpha,8abeta))-
- IUPAC
- 2-(3,8-dimethyl-1,2,3,3a,4,5,6,7,8,8a-decahydroazulen-5-yl)propan-2-ol
- 영어명
- [3S-(3alpha,3abeta,5alpha,8alpha,8abeta)]-decahydro-alpha,alpha,3,8-tetramethylazulene-5-methanol
- 분자식
- C15H28O
- 분자량
- 224.38
이름 및 동의어
5-Azulenemethanol, decahydro-alpha,alpha,3,8-tetramethyl-, (3S-(3alpha,3abeta,5alpha,8alpha,8abeta))-RefChem:5325285-Azulenemethanol, decahydro-.alpha.,.alpha.,3,8-tetramethyl-, [3S-(3.alpha.,3a.beta.,5.alpha.,8.alpha.,8a.beta.)]-3526-75-82-(3,8-dimethyldecahydroazulen-5-yl)propan-2-ol2-(3,8-dimethyl-1,2,3,3a,4,5,6,7,8,8a-decahydroazulen-5-yl)propan-2-olNS00012189(3S-(3alpha,3Abeta,5alpha,8alpha,8abeta))-decahydro-alpha,alpha,3,8-tetramethylazulene-5-methanolEinecs 222-546-0(3S,3aβ,8aβ)-Decahydro-α,α,3α,8α-tetramethyl-5α-azulenemethanol5-Azulenemethanol, decahydro-α,α,3,8-tetramethyl-, (3S,3aS,5R,8S,8aS)-[3S-(3α,3aβ,5α,8α,8aβ)]-decahydro-α,α,3,8-tetramethylazulene-5-methanol
이름 더 보기
(3aS)-1t.4t-dimethyl-7t-(α-hydroxy-isopropyl)-(3arH.8acH)-decahydro-azulene5-Azulenemethanol, decahydro-alpha,alpha,3,8-tetramethyl-, (3S,3as,5R,8S,8as)-[3S-(3alpha,3abeta,5alpha,8alpha,8abeta)]-decahydro-alpha,alpha,3,8-tetramethylazulene-5-methanoldecahydro-.alpha.,.alpha.-3,8-tetramethyl-[3S-(3.alpha.,3a.beta., 5.alpha.,8.alpha.,8a.beta.)]-5-Azulenemethanol
물성
구조 계산 물성
- XLogP
- 4.4
- 극성 표면적
- 20.2 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 16
- 형식 전하
- 0
- 복잡도
- 246
실험 및 물리화학적 성질
FragrancesFragrance Ingredient (1.alpha.,5.alpha.-Dihydroguaiol) -> IFRA transparency List
물리화학적 성질
- 화장품 원료 기능
- 향수
- LogP
- 5.28 · 5.280 (est)
- EPA
- 5 · 5-Azulenemethanol, decahydro-.alpha.,.alpha.,3,8-tetramethyl-, (3S,3aS,5R,8S,8aS)- (3526-75-8)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 1375 reports by companies from 1 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory InformationChemical: 5-Azulenemethanol, decahydro-.alpha.,.alpha.,3,8-tetramethyl-, [3S-(3.alpha.,3a.beta.,5.alpha.,8.alpha.,8a.beta.)]-
Other Safety InformationIMAP assessments - 5-Azulenemethanol, decahydro-.alpha.,.alpha.,3,8-tetramethyl-, [3S-(3.alpha.,3a.beta.,5.alpha.,8.alpha.,8a.beta.)]-: Human health tier I assessment
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
Use ClassificationFragrance Ingredients
공급사2 곳
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…