기본 정보
- CAS
20405-60-1- 표준 SMILES
C=C(C)C1CCC(C)C(OC(C)=O)C1- InChIKey
TUSIZTVSUSBSQI-UHFFFAOYSA-N- 분자식
- C12H20O2
- 평균 분자량
- 196.29 g/mol
- 단동위원소 질량
- 196.14632988
개요
Dihydrocarveol acetate is a p-menthane monoterpenoid.
이름 및 식별자
- 우선 이름
- Dihydrocarvyl acetate
- IUPAC
- (2-methyl-5-prop-1-en-2-ylcyclohexyl) acetate
이름 및 동의어
Dihydrocarvyl acetateTuberyl acetateDihydrocarveyl acetateCarhydrine8-p-Menthen-2-yl acetateFEMA No. 2380Menth-8(9)-en-2-yl acetate, p-p-Menth-8(9)-en-2-yl acetateCyclohexanol, 2-methyl-5-(1-methylethenyl)-, acetate, (1R,2R,5R)-rel-EINECS 243-794-6Cyclohexanol, 2-methyl-5-(1-methylethenyl)-, 1-acetate2-Methyl-5-(1-methylethenyl)cyclohexyl acetate, (1alpha,2beta,5alpha)-
이름 더 보기
EINECS 244-029-9Cyclohexanol, 2-methyl-5-(1-methylethenyl)-, acetate, (1-alpha,2-beta,5-alpha)-RefChem:587707Cyclohexanol, 2-methyl-5-(1-methylethenyl)-, acetate, (1-alpha,2-beta,5-alpha)-(9CI)20777-49-5Dihydrocarveol acetate20405-60-1p-Menth-8-en-2-yl acetate
데이터베이스 식별자
- CAS
20405-60-1、20777-49-5- PubChem CID
- 30248
- DTXSID
DTXSID00864942- ChEMBL
CHEMBL1730107- ChEBI
CHEBI:172055- EC Number
- 243-794-6、244-029-9
- Nikkaji
- J160.107E、J236.213I
물성
구조 계산 물성
- XLogP
- 3.5
- 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
- 232
실험 및 물리화학적 성질
FragrancesFragrance Ingredient (Dihydrocarvyl acetate) -> IFRA transparency List
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density0.943-0.954
Flavoring AgentsEU Flavoring substances
Solubility
slightly
slightly soluble in water; soluble in alcohol
(in ethanol)
Boiling Point
232.00 to 234.00 °C. @ 760.00 mm Hg
238 °C
Refractive Index1.458-1.463
Physical Descriptioncolourless to pale yellow liquid
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% (1407 of 1407) of all reports.
Not Classified
Aggregated GHS information provided per 1407 reports by companies from 1 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory Information
Regulation (EC) No 1831/2003 (amended)
Cyclohexanol, 2-methyl-5-(1-methylethenyl)-, acetate, (1R,2R,5R)-rel-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesNot Classified
화학 및 산업
약리 정보
Cellular LocationsExtracellular
용도 및 제조
Use Classification
Fragrance Ingredients
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
General Manufacturing Information
Cyclohexanol, 2-methyl-5-(1-methylethenyl)-, 1-acetate: INACTIVE
Cyclohexanol, 2-methyl-5-(1-methylethenyl)-, 1-acetate, (1R,2R,5R)-rel-: ACTIVE
관련 반응
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