기본 정보
- CAS
41816-03-9- 표준 SMILES
CC1=CCC2C3CC(C2C1)C1(C3)OC1C- InChIKey
VKPRTBDRPNWOGL-UHFFFAOYSA-N- 분자식
- C14H20O
- 평균 분자량
- 204.31 g/mol
- 단동위원소 질량
- 204.15141526
이름 및 식별자
- 우선 이름
- Rhubofix
- IUPAC
- 3,4'-dimethylspiro[oxirane-2,10'-tricyclo[6.2.1.02,7]undec-4-ene]
- 영어명
- 3,7'-Dimethyl-3,4,4a,5,8,8a-hexahydrospiro-(1,4-methanonaphthalene- 2(1H),2'-oxirane)
- 분자식
- C14H20O
- 분자량
- 204.31
이름 및 동의어
RhubofixSpiro(1,4-methanonaphthalene-2(1H),2'-oxirane), 3,4,4a,5,8,8a-hexahydro-3',7-dimethyl-EINECS 255-560-0DTXSID60520893,4,4a,5,8,8a-Hexahydro-3',7'-dimethylspiro[1,4-methanonaphthalene-2(1H),2'-oxirane]3,4,4a,5,8,8a-Hexahydro-3',7 (or 6)-dimethylspiro(1,4-methanonaphthalene-2(1H),2'-oxirane)3,4,4a,5,8,8a-Hexahydro-3',7-dimethylspiro[1,4-methanonaphthalene-2(1H),2'-oxirane]Spiro[1,4-methanonaphthalene-2(1H),2'-oxirane], 3,4,4a,5,8,8a-hexahydro-3',7-dimethyl-3,4,4a,5,8,8a-Hexahydro-3',7'-dimethylspiro(1,4-methanonaphthalene-2(1H),2'-oxirane)3,4,4a,5,8,8a-Hexahydro-3',7-dimethylspiro(1,4-methanonaphthalene-2(1H),2'-oxirane)RefChem:883071DTXCID1030656
이름 더 보기
RHUBOFIX, FIRMENICH3,5'-Dimethylspiro[oxirane-2,9'-tricyclo[6.2.1.02,7]undec[4]ene]3,5'-Dimethylspiro[oxirane-2,9'-tricyclo[6.2.1.02,7]undec[4]ene]3,7''-Dimethyl-3,4,4a,5,8,8a-hexahydrospiro-(1,4-methanonaphthalene- 2(1H),23,4,4a,5,8,8a-Hexahydro-3′,7′-dimethylspiro(1,4-methanonaphthalin-2(1H),2′-oxiran)Spiro1,4-methanonaphthalene-2(1H),2-oxirane, 3,4,4a,5,8,8a-hexahydro-3,7-dimethyl-
255-560-041816-03-93,4'-dimethylspiro[oxirane-2,10'-tricyclo[6.2.1.02,7]undec-4-ene]3,7'-Dimethyl-3,4,4a,5,8,8a-hexahydrospiro-(1,4-methanonaphthalene- 2(1H),2'-oxirane)rhubarb oxiraneSCHEMBL3504089VKPRTBDRPNWOGL-UHFFFAOYSA-NRBA81603
데이터베이스 식별자
- CAS
41816-03-9- PubChem CID
- 94522
- DTXSID
DTXSID6052089- EC Number
- 255-560-0
- Nikkaji
- J248.398J
물성
구조 계산 물성
- XLogP
- 2.5
- 극성 표면적
- 12.5 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 0
- 무거운 원자 수
- 15
- 형식 전하
- 0
- 복잡도
- 345
실험 및 물리화학적 성질
FragrancesFragrance Ingredient (3,4,4a,5,8,8a-Hexahydro-3',7-dimethylspiro[1,4-methanonaphthalene-2(1H),2'-oxirane]) -> IFRA transparency List
Endocrine DisruptorsPotential endocrine disrupting compound
물리화학적 성질
- 끓는 점
- 291.9 · 291.9±39.0 °C(Predicted)
- 밀도
- 1.09 · 1.09±0.1 g/cm3(Predicted)
- 냄새
- 10 % · 디프로필렌 글리콜 중 10.00%. 신선한 우디 스파이시 플로럴 프루티 루바브 제스티
- 냄새 유형
- 우디
- 화장품 원료 기능
- 향수
- LogP
- 3.79 · 3.790 (est)
- EPA
- 1 · Spiro[1,4-methanonaphthalene-2(1H),2'-oxirane], 3,4,4a,5,8,8a-hexahydro-3',7-dimethyl- (41816-03-9)
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 95.4% (267 of 280) of all reports.
Not Classified
Aggregated GHS information provided per 280 reports by companies from 3 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory Information
Chemical: Spiro[1,4-methanonaphthalene-2(1H),2'-oxirane], 3,4,4a,5,8,8a-hexahydro-3',7-dimethyl-
Spiro[1,4-methanonaphthalene-2(1H),2'-oxirane], 3,4,4a,5,8,8a-hexahydro-3',7-dimethyl-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesNot Classified
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
Household ProductsInformation on 1 consumer products that contain Rhubofix in the following categories is provided:
Use ClassificationFragrance Ingredients
General Manufacturing InformationSpiro[1,4-methanonaphthalene-2(1H),2'-oxirane], 3,4,4a,5,8,8a-hexahydro-3',7-dimethyl-: ACTIVE
응용 분야
용도Rhubofix is a compound that has a woody, spicy, and fruity note that is used in fragrance formulations.
공급사17 곳
Hebei Yanxi Chemical Co., Ltd.+86-17531190177 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
成都普思生物科技股份有限公司028-85370565-229 18080489829 · [email protected]
吉良化学21-62165282 · [email protected]
Henan Alfa Chemical Co., Ltd+8618339805032 · [email protected]
泰安嘉岳生物化工有限公司15318151873 · [email protected]
BOC Sciences[email protected]
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