기본 정보
- CAS
1205-42-1- 표준 SMILES
C=C(C)[C@@H]1CC=C(C)[C@H](OC(C)=O)C1- InChIKey
YTHRBOFHFYZBRJ-VXGBXAGGSA-N- 분자식
- C12H18O2
- 평균 분자량
- 194.27 g/mol
- 단동위원소 질량
- 194.13067981
개요
(1R,5R)-carvyl acetate has been reported in Artemisia annua with data available.
이름 및 식별자
- 우선 이름
- 2-Cyclohexen-1-ol, 2-methyl-5-(1-methylethenyl)-, 1-acetate, (1R,5R)-rel-
- IUPAC
- [(1R,5R)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl] acetate
- 영어명
- (1R-cis)-2-methyl-5-(1-methylvinyl)cyclohex-2-en-1-yl acetate
- 분자식
- C12H18O2
- 분자량
- 194.27012
이름 및 동의어
2-Cyclohexen-1-ol, 2-methyl-5-(1-methylethenyl)-, acetate, cis-p-Mentha-6,8-dien-2-ol, acetate, cis-EINECS 214-883-7[(1R,5R)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl] acetatecis-2-Methyl-5-(1-methylvinyl)cyclohex-2-en-1-yl acetate(1R-cis)-2-Methyl-5-(1-methylvinyl)cyclohex-2-en-1-yl acetateDTXSID4010145572-Cyclohexen-1-ol, 2-methyl-5-(1-methylethenyl)-, 1-acetate, (1R,5R)-rel-((1R,5R)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl) acetateRefChem:470841DTXCID201437127214-883-7
이름 더 보기
(1S,5S)-carvyl acetateEinecs 230-414-9cis-(-)-Carvil acetate(-)-cis-Carveol acetate[2R,4R,(-)]-p-Mentha-6(1),8-dien-2-ol acetate(1R-cis)-2-methyl-5-(1-methylethenyl)-2-cyclohexen-1-ol acetate[1R,5R,(-)]-2-Methyl-5-(1-methylethenyl)-2-cyclohexen-1-ol acetate2-Cyclohexen-1-ol, 2-methyl-5-(1-methylethenyl)-, 1-acetate, (1R,5R)-
cis-Carvyl acetateCarvyl acetate, (1R,5R)-7111-29-71205-42-15481G91UGI(1R,5R)-carvyl acetatecis-l-Carvyl acetate2-Cyclohexen-1-ol, 2-methyl-5-(1-methylethenyl)-, acetate, (1R-cis)-
데이터베이스 식별자
- CAS
1205-42-1、7111-29-7- PubChem CID
- 102024
- DTXSID
DTXSID401014557- UNII
- 5481G91UGI
- EC Number
- 214-883-7、230-414-9
- Nikkaji
- J103.998I
물성
구조 계산 물성
- XLogP
- 2.6
- 극성 표면적
- 26.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 14
- 형식 전하
- 0
- 복잡도
- 276
실험 및 물리화학적 성질
FragrancesFragrance Ingredient (laevo-Carvyl acetate) -> IFRA transparency List
물리화학적 성질
- 끓는 점
- 300.2 · 300.2±0.0 °C(Predicted)
- 밀도
- 0.96 · 0.96±0.1 g/cm3(Predicted)
- LogP
- 3.359 · 3.359 (est)
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 100% (114 of 114) of all reports.
Not Classified
Aggregated GHS information provided per 114 reports by companies from 1 notifications to the ECHA C&L Inventory.
This chemical does not meet GHS hazard criteria for 100% (25 of 25) of all reports.
Not Classified
Aggregated GHS information provided per 25 reports by companies from 1 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory InformationChemical: 2-Cyclohexen-1-ol, 2-methyl-5-(1-methylethenyl)-, acetate, cis-
Other Safety InformationIMAP assessments - 2-Cyclohexen-1-ol, 2-methyl-5-(1-methylethenyl)-, acetate, cis-: Environment tier I assessment
Hazard Classes and Categories
Not Classified
Not Classified
화학 및 산업
용도 및 제조
Use ClassificationFragrance Ingredients
General Manufacturing Information2-Cyclohexen-1-ol, 2-methyl-5-(1-methylethenyl)-, 1-acetate, (1R,5R)-rel-: ACTIVE
상·하류 제품 정보
하류 제품
공급사3 곳
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
上海问彩新材料科技有限公司15721586846 · [email protected]
湖北玖天生物医药科技有限公司027-88013699 17354350817 · [email protected]
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