기본 정보
- CAS
67845-30-1- 표준 SMILES
CC1=CC2CC(C=O)C1CC2C(C)C- InChIKey
OWFZJSXGDOTWSH-UHFFFAOYSA-N- 분자식
- C13H20O
- 평균 분자량
- 192.3 g/mol
- 단동위원소 질량
- 192.15141526
이름 및 식별자
- 우선 이름
- Bicyclo[2.2.2]oct-5-ene-2-carboxaldehyde, 6-methyl-8-(1-methylethyl)-
- IUPAC
- 6-methyl-8-propan-2-ylbicyclo[2.2.2]oct-5-ene-2-carbaldehyde
- 영어명
- 7-Formyl-5-isopropyl-2-methylbicyclo(2.2.2)oct-2-ene
- 분자식
- C13H20O
- 분자량
- 192.3
이름 및 동의어
67845-30-1Bicyclo[2.2.2]oct-5-ene-2-carboxaldehyde, 6-methyl-8-(1-methylethyl)-7-Formyl-5-isopropyl-2-methylbicyclo(2.2.2)oct-2-eneEINECS 267-308-78-isopropyl-6-methylbicyclo[2.2.2]oct-5-ene-2-carbaldehydeDTXSID008673572-Methyl-5-(1-methylethyl)bicyclo(2.2.2)oct-2-ene-7-carboxaldehydeBicyclo(2.2.2)oct-5-ene-2-carboxaldehyde, 6-methyl-8-(1-methylethyl)-8-Isopropyl-6-methylbicyclo(2.2.2)oct-5-ene-2-carbaldehydeRefChem:568172DTXCID90815549Bicyclo2.2.2oct-5-ene-2-carboxaldehyde, 6-methyl-8-(1-methylethyl)-
이름 더 보기
MACEAL7-Formyl-5-isopropyl-2-methylbicyclo(2.2.2)-oct-2-end6-Methyl-8-isopropylbicyclo[2.2.2]octa-5-ene-2-carbaldehyde6-Methyl-8-(1-methylethyl)bicyclo[2.2.2]oct-5-ene-2-carbaldehyde6-methyl-8-(1-methylethyl)-bicyclo[2.2.2]oct-5-ene-2-carboxaldehyd
267-308-76-methyl-8-propan-2-ylbicyclo[2.2.2]oct-5-ene-2-carbaldehydebark carbaldehyde6-methyl-8-(propan-2-yl)bicyclo[2.2.2]oct-5-ene-2-carbaldehydeSCHEMBL229226SCHEMBL28807337OWFZJSXGDOTWSH-UHFFFAOYSA-NNS00012745
물성
구조 계산 물성
- XLogP
- 2.6
- 극성 표면적
- 17.1 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 14
- 형식 전하
- 0
- 복잡도
- 264
실험 및 물리화학적 성질
FragrancesFragrance Ingredient (8-Isopropyl-6-methylbicyclo[2.2.2]oct-5-ene-2-carbaldehyde) -> IFRA transparency List
물리화학적 성질
- 끓는 점
- 262.9 · 262.9±29.0 °C(Predicted)
- 밀도
- 0.996 · 0.996±0.06 g/cm3(Predicted)
- 냄새
- 1 % · 디프로필렌 글리콜 중 1.00%. 신선한 풀 기름진 녹색 매운맛
- 냄새 유형
- 녹색
- 화장품 원료 기능
- 향수
- LogP
- 3.96 · 3.960 (est)
- EPA
- 2.2 · Bicyclo[2.2.2]oct-5-ene-2-carboxaldehyde, 6-methyl-8-(1-methylethyl)- (67845-30-1)
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 0.4% (1 of 276) of reports.
Warning
H317 (99.6%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 276 reports by companies from 3 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory Information
Chemical: Bicyclo[2.2.2]oct-5-ene-2-carboxaldehyde, 6-methyl-8-(1-methylethyl)-
Bicyclo2.2.2oct-5-ene-2-carboxaldehyde, 6-methyl-8-(1-methylethyl)-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Sens. 1B (99.6%)
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
Use ClassificationFragrance Ingredients
General Manufacturing InformationBicyclo[2.2.2]oct-5-ene-2-carboxaldehyde, 6-methyl-8-(1-methylethyl)-: ACTIVE
공급사3 곳
武汉卡诺斯科技有限公司027-83238443 15327105076 · [email protected]
武汉柔博医药化工有限公司027-027-87827088 18986164924 · [email protected]
湖北东曹化学科技有限公司027-83238443 13343438265 · [email protected]
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