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기본 정보
- CAS
35964-50-2- 표준 SMILES
Cc1cc2c(c(C)c1CCO)C(=O)[C@H](CO)C2- InChIKey
LGXRGPOUGZXSEB-NSHDSACASA-N- 분자식
- C14H18O3
- 평균 분자량
- 234.29 g/mol
- 단동위원소 질량
- 234.12559443
이름 및 식별자
- 우선 이름
- (2S)-2,3-Dihydro-6-(2-hydroxyethyl)-2-(hydroxymethyl)-5,7-dimethyl-1H-inden-1-one
- IUPAC
- (2S)-6-(2-hydroxyethyl)-2-(hydroxymethyl)-5,7-dimethyl-2,3-dihydroinden-1-one
- 영어명
- (S)-2,3-Dihydro-6-(2-hydroxyethyl)-2-hydroxymethyl-5,7-dimethyl-1H-inden-1-one
- 분자식
- C14H18O3
- 분자량
- 234.29
이름 및 동의어
35964-50-2(2S)-2,3-Dihydro-6-(2-hydroxyethyl)-2-(hydroxymethyl)-5,7-dimethyl-1H-inden-1-oneRefChem:1049923Pterosin G(S)-2,3-Dihydro-6-(2-hydroxyethyl)-2-(hydroxymethyl)-5,7-dimethyl-1H-inden-1-one1H-Inden-1-one, 2,3-dihydro-6-(2-hydroxyethyl)-2-(hydroxymethyl)-5,7-dimethyl-, (S)-(2S)-6-(2-hydroxyethyl)-2-(hydroxymethyl)-5,7-dimethyl-2,3-dihydroinden-1-oneorb1991754SCHEMBL13242316SCHEMBL30018961DTXSID30189514AKOS040735002
이름 더 보기
(S)-2,3-Dihydro-6-(2-hydroxyethyl)-2-hyd(S)-2,3-Dihydro-6-(2-hydroxyethyl)-2-hydroxymethyl-5,7-dimethyl-1H-inden-1-one1H-Inden-1-one, 2,3-dihydro-6-(2-hydroxyethyl)-2-(hydroxymethyl)-5,7-dimethyl-, (2S)-
(2S)-6-(2-hydroxyethyl)-2-(hydroxymethyl)-5,7-dimethyl-2,3-dihydro-1H-inden-1-oneNS00066982T124956(S)-6-(2-Hydroxyethyl)-2-(hydroxymethyl)-5,7-dimethyl-2,3-dihydro-1H-inden-1-one
데이터베이스 식별자
물성
구조 계산 물성보충 중
- XLogP
- 1.9
- 극성 표면적
- 57.5 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 17
- 형식 전하
- 0
- 복잡도
- 289
물리화학적 성질
- 끓는 점
- 458.1 · 458.1±45.0 °C(Predicted)
- 밀도
- 1.192 · 1.192±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 14.35 · 14.35±0.10(Predicted)
화학 및 산업
공급사7 곳
武汉众志诚生物技术有限公司13628624121 13628604890 · [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]
上海诗丹德标准技术服务有限公司021-021-57127007-6622-6622 17621252073 · [email protected]
四川省维克奇生物科技有限公司028-81700200 18116577057 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
Shanghai Standard Technology Co., Ltd.18502101150 · [email protected]
上海莫奇生物科技有限公司13341702378 · [email protected]
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