3-Allyl-4-hydroxy-4,5-dimethyl-5-(4-methyl-3-pentenyl)-1,3-oxazolidin-2-one
기본 정보
- CAS
312281-30-4- 표준 SMILES
C=CCN1C(=O)OC(C)(CCC=C(C)C)C1(C)O- InChIKey
UOKVKKBVZREBLQ-UHFFFAOYSA-N- 분자식
- C14H23NO3
- 평균 분자량
- 253.34 g/mol
이름 및 식별자
- 우선 이름
- 3-Allyl-4-hydroxy-4,5-dimethyl-5-(4-methyl-3-pentenyl)-1,3-oxazolidin-2-one
- IUPAC
- 4-hydroxy-4,5-dimethyl-5-(4-methylpent-3-enyl)-3-prop-2-enyl-1,3-oxazolidin-2-one
- 영어명
- 3-Allyl-4-hydroxy-4,5-dimethyl-5-(4-methyl-3-pentenyl)-1,3-oxazolidin-2-one
- 분자식
- C14H23NO3
- 분자량
- 253.34
이름 및 동의어
3-allyl-4-hydroxy-4,5-dimethyl-5-(4-methyl-3-pentenyl)-1,3-oxazolidin-2-one312281-30-44-hydroxy-4,5-dimethyl-5-(4-methylpent-3-en-1-yl)-3-(prop-2-en-1-yl)-1,3-oxazolidin-2-one4-hydroxy-4,5-dimethyl-5-(4-methylpent-3-enyl)-3-prop-2-enyl-1,3-oxazolidin-2- oneChemDiv2_002349Oprea1_205576CHEMBL4917537HMS1375K17SBB002022STK674233AKOS0055935174-hydroxy-4,5-dimethyl-5-(4-methylpent-3-enyl)-3-prop-2-enyl-1,3-oxazolidin-2-one
이름 더 보기
2-Oxazolidinone, 4-hydroxy-4,5-dimethyl-5-(4-methyl-3-penten-1-yl)-3-(2-propen-1-yl)-
ST008205EU-0051823AG-205/37153027SR-01000103739SR-01000103739-13-allyl-4-hydroxy-4,5-dimethyl-5-(4-methyl-3-pentenyl)oxazolidin-2-one3-Allyl-4-hydroxy-4,5-dimethyl-5-(4-methylpent-3-en-1-yl)oxazolidin-2-one
데이터베이스 식별자
- CAS
312281-30-4- ChEMBL
CHEMBL4917537
물성
구조 계산 물성
- XLogP
- 2.8
- 극성 표면적
- 49.8 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 373
물리화학적 성질
- 녹는점
- 40 · 40-70 °C
- 끓는 점
- 397.3 · 397.3±42.0 °C(Predicted)
- 밀도
- 1.024 · 1.024±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 12.71 · 12.71±0.40(Predicted)
관련 반응
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