기본 정보
- CAS
69882-09-3- 표준 SMILES
CC(=O)C1CC2(C(C)C)C=CC1(C)CC2- InChIKey
FPUZVGQCOIRCIA-UHFFFAOYSA-N- 분자식
- C14H22O
- 평균 분자량
- 206.32 g/mol
- 단동위원소 질량
- 206.16706532
이름 및 식별자
- 우선 이름
- Ethanone, 1-[1(or 4)-methyl-4(or 1)-(1-methylethyl)bicyclo[2.2.2]oct-5-en-2-yl]-
- IUPAC
- 1-(1-methyl-4-propan-2-yl-2-bicyclo[2.2.2]oct-5-enyl)ethanone
이름 및 동의어
EINECS 274-184-869882-09-31-(1(or 4)-Methyl-4(or 1)-(1-methylethyl)bicyclo(2.2.2)oct-5-en-2-yl)ethanoneEthanone, 1-(1(or 4)-methyl-4(or 1)-(1-methylethyl)bicyclo(2.2.2)oct-5-en-2-yl)-1-Methyl-4-isopropyl-2(3)-acetylbicyclo(2.2.2)oct-5-eneEthanone, 1-[1(or 4)-methyl-4(or 1)-(1-methylethyl)bicyclo[2.2.2]oct-5-en-2-yl]-1-[1(or 4)-Methyl-4(or 1)-(1-methylethyl)bicyclo[2.2.2]oct-5-en-2-yl]ethanoneRefChem:592398Ethanone, 1-1(or 4)-methyl-4(or 1)-(1-methylethyl)bicyclo2.2.2oct-5-en-2-yl-SCHEMBL3505326FPUZVGQCOIRCIA-UHFFFAOYSA-NNS00121390
이름 더 보기
1-(1(Or 4)-methyl-4(or 1)-(1-methylethyl)bicyclo(2.2.2)oct-5-en-2-yl)ethan-1-one
데이터베이스 식별자
- CAS
69882-09-3- PubChem CID
- 112169
- EC Number
- 274-184-8
물성
구조 계산 물성
- XLogP
- 3.8
- 극성 표면적
- 17.1 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 15
- 형식 전하
- 0
- 복잡도
- 315
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
유해성 정보
Regulatory Information
Chemical: Ethanone, 1-[1(or 4)-methyl-4(or 1)-(1-methylethyl)bicyclo[2.2.2]oct-5-en-2-yl]-
Ethanone, 1-1(or 4)-methyl-4(or 1)-(1-methylethyl)bicyclo2.2.2oct-5-en-2-yl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
화학 및 산업
용도 및 제조
General Manufacturing InformationEthanone, 1-[1(or 4)-methyl-4(or 1)-(1-methylethyl)bicyclo[2.2.2]oct-5-en-2-yl]-: INACTIVE
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