기본 정보
- CAS
68901-22-4- 표준 SMILES
CC1CC(CC2C3CCC(C3)C2(C)C)CCC1=O- InChIKey
TUCJTYGBRWODLS-UHFFFAOYSA-N- 분자식
- C17H28O
- 평균 분자량
- 248.4 g/mol
- 단동위원소 질량
- 248.21401551
이름 및 식별자
- 우선 이름
- 4-((3,3-Dimethylbicyclo(2.2.1)hept-2-yl)methyl)-2-methylcyclohexanone
- IUPAC
- 4-[(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)methyl]-2-methylcyclohexan-1-one
이름 및 동의어
68901-22-4Cyclohexanone, 4-((3,3-dimethylbicyclo(2.2.1)hept-2-yl)methyl)-2-methyl-Cyclohexanone, 4-[(3,3-dimethylbicyclo[2.2.1]hept-2-yl)methyl]-2-methyl-RefChem:5091054-((3,3-Dimethylbicyclo(2.2.1)hept-2-yl)methyl)-2-methylcyclohexanone272-665-72-Methyl-4-(camphenyl-8)-cyclohexanone4-((3,3-dimethylbicyclo[2.2.1]heptan-2-yl)methyl)-2-methylcyclohexan-1-oneEINECS 272-665-7SCHEMBL1793773TUCJTYGBRWODLS-UHFFFAOYSA-N2-methyl-4-(camphenyl-8) cyclohexanone
이름 더 보기
NS00012270
데이터베이스 식별자
- CAS
68901-22-4- PubChem CID
- 111416
- EC Number
- 272-665-7
- Nikkaji
- J332.717E
물성
구조 계산 물성
- XLogP
- 4.9
- 극성 표면적
- 17.1 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 344
실험 및 물리화학적 성질
FragrancesFragrance Ingredient (2-Methyl-4-(camphenyl-8)-cyclohexanone) -> IFRA transparency List
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 68.7% (79 of 115) of all reports.
Warning
H317 (31.3%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P273, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 115 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: Cyclohexanone, 4-[(3,3-dimethylbicyclo[2.2.1]hept-2-yl)methyl]-2-methyl-
Cyclohexanone, 4-(3,3-dimethylbicyclo2.2.1hept-2-yl)methyl-2-methyl-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Sens. 1B (31.3%)
화학 및 산업
용도 및 제조
Use ClassificationFragrance Ingredients
General Manufacturing InformationCyclohexanone, 4-[(3,3-dimethylbicyclo[2.2.1]hept-2-yl)methyl]-2-methyl-: ACTIVE
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