기본 정보
- CAS
52475-89-5- 표준 SMILES
CC(C)=CCCC1=CCCC(C=O)C1- InChIKey
RKXHUEKKGCBVSR-UHFFFAOYSA-N- 분자식
- C13H20O
- 평균 분자량
- 192.3 g/mol
- 단동위원소 질량
- 192.15141526
이름 및 식별자
- 우선 이름
- 3-Cyclohexene-1-carboxaldehyde, 3-(4-methyl-3-penten-1-yl)-
- IUPAC
- 3-(4-methylpent-3-enyl)cyclohex-3-ene-1-carbaldehyde
- 영어명
- 3-(4-methyl-3-pentenyl)cyclohex-3-ene-1-carbaldehyde
- 분자식
- C13H20O
- 분자량
- 192.3
이름 및 동의어
3-Cyclohexene-1-carboxaldehyde, 3-(4-methyl-3-pentenyl)-1-Formyl-3-isohexenyl-3-cyclohexene3-(4-Methyl-3-pentenyl)cyclohex-3-ene-1-carbaldehydeEINECS 257-943-83-Cyclohexene-1-carboxaldehyde, 3-(4-methyl-3-penten-1-yl)-RefChem:500734257-943-8Myrac aldehyde 152475-89-53-(4-methylpent-3-en-1-yl)cyclohex-3-ene-1-carbaldehydem-Myrac aldehydeSCHEMBL717922
이름 더 보기
1-(4-Methyl-3-pentenyl)cyclohexene-5-carbaldehyde3-(4-Methyl-3-pentenyl)-3-cyclohexene-1-carbaldehyde3-(4-methyl-3-pentenyl)-3-Cyclohexene-1-carboxaldehyde
DTXSID10521611-Formyl-3-(3-isohexenyl)-3-cyclohexeneDB-303888NS000129643-(4-Methyl-3-penten-1-yl)-3-cyclohexene-1-carbaldehyde3-(4-Methyl-3-pentenyl)-3-cyclohexene-1-carbaldehyde #
데이터베이스 식별자
- CAS
52475-89-5- PubChem CID
- 103649
- DTXSID
DTXSID1052161- EC Number
- 257-943-8
- Nikkaji
- J24.286A
물성
구조 계산 물성
- XLogP
- 3
- 극성 표면적
- 17.1 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 14
- 형식 전하
- 0
- 복잡도
- 244
실험 및 물리화학적 성질
FragrancesFragrance Ingredient (3-(4-Methyl-3-pentenyl)cyclohex-3-ene-1-carbaldehyde) -> IFRA transparency List
물리화학적 성질
- 끓는 점
- 273.7 · 273.7±39.0 °C(Predicted)
- 밀도
- 0.955 · 0.955±0.06 g/cm3(Predicted)
- 냄새
- 100 %에서 · 100.00%에서. 알데히드 오렌지 오조닉 프루티 클린 아웃도어
- 냄새 유형
- 알데히드계
- 화장품 원료 기능
- 향수
- LogP
- 3.633 · 3.633 (est)
- EPA
- 3 · 3-Cyclohexene-1-carboxaldehyde, 3-(4-methyl-3-pentenyl)- (52475-89-5)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H317 (88.5%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P273, P280, P302+P352, P321, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 454 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory InformationChemical: 3-Cyclohexene-1-carboxaldehyde, 3-(4-methyl-3-pentenyl)-
Other Safety InformationIMAP assessments - 3-Cyclohexene-1-carboxaldehyde, 3-(4-methyl-3-pentenyl)-: Environment tier I assessment
Hazard Classes and CategoriesSkin Sens. 1B (88.5%)
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
Household ProductsInformation on 4 consumer products that contain Methylpentenylcyclohexene Carbaldehyde in the following categories is provided:
Use ClassificationFragrance Ingredients
General Manufacturing Information3-Cyclohexene-1-carboxaldehyde, 3-(4-methyl-3-penten-1-yl)-: ACTIVE
상·하류 제품 정보
하류 제품
공급사1 곳
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
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