기본 정보
- CAS
50727-94-1- 표준 SMILES
CC(C)=CCCC1(C)OC1CO- InChIKey
RZRBXGPSHVAUQO-UHFFFAOYSA-N- 분자식
- C10H18O2
- 평균 분자량
- 170.25 g/mol
- 단동위원소 질량
- 170.13067982
개요
2,3-Epoxy-3,7-dimethyloct-6-enol has been reported in Zanthoxylum schinifolium, Salvia sclarea, and other organisms with data available.
이름 및 식별자
- 우선 이름
- Oxiranemethanol, 3-methyl-3-(4-methyl-3-pentenyl)-
- IUPAC
- [3-methyl-3-(4-methylpent-3-enyl)oxiran-2-yl]methanol
- 현지명
- 2,3-에폭시-3,7-디메틸옥트-6-에놀
- 영어명
- 2,3-epoxy-3,7-dimethyloct-6-enol
- 분자식
- C10H18O2
- 분자량
- 170.25
이름 및 동의어
Oxiranemethanol, 3-methyl-3-(4-methyl-3-pentenyl)-RefChem:8577482,3-Epoxy-3,7-dimethyloct-6-enol50727-94-1(2S,3S)-EpoxygeraniolEINECS 256-740-1[3-methyl-3-(4-methylpent-3-enyl)oxiran-2-yl]methanol[3-METHYL-3-(4-METHYLPENT-3-EN-1-YL)OXIRAN-2-YL]METHANOLtrans-Linaloloxide[3-Methyl-3-(4-methyl-3-pentenyl)-2-oxiranyl]methanolracemic nerol oxideZAP6AZ2WW7
이름 더 보기
2,3-에폭시-3,7-디메틸옥트-6-에놀2-Oxiranemethanol, 3-methyl-3-(4-methyl-3-penten-1-yl)-
SCHEMBL310618DTXSID40964970HDA18873AKOS0159059636-Octen-1-ol, 2,3-epoxy-3,7-dimethyl-NS000582953,7-DIMETHYL-2,3-EPOXY-6-OCTEN-1-OL3-Methyl-3-(4-methyl-3-penten-1-yl)-2-oxiranemethanol
데이터베이스 식별자
- CAS
50727-94-1- PubChem CID
- 530403
- DTXSID
DTXSID40964970- UNII
- ZAP6AZ2WW7
- EC Number
- 256-740-1
- Nikkaji
- J264.185B
물성
구조 계산 물성
- XLogP
- 1.8
- 극성 표면적
- 32.8 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 182
물리화학적 성질
- 끓는 점
- 80 · 80-82 °C(Press: 0.7 Torr)
- 밀도
- 0.9601 g/cm3 · 0.9601 g/cm3
- 산도 계수 (pKa)
- 14.44 · 14.44±0.10(Predicted)
안전 및 규제
유해성 정보
Regulatory InformationChemical: Oxiranemethanol, 3-methyl-3-(4-methyl-3-pentenyl)-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
화학 및 산업
공급사1 곳
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
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