기본 정보
- CAS
220626-12-0- 표준 SMILES
CCOC(=O)C1=C[C@@H](O)[C@@H](O)[C@H](OS(C)(=O)=O)C1- InChIKey
XRWVWZDGWXYWDC-IWSPIJDZSA-N- 분자식
- C10H16O7S
- 평균 분자량
- 280.3 g/mol
- 단동위원소 질량
- 280.06167402
이름 및 식별자
- 우선 이름
- ethyl (3R,4R,5R)-3,4-dihydroxy-5-methylsulfonyloxycyclohexene-1-carboxylate
- IUPAC
- ethyl (3R,4R,5R)-3,4-dihydroxy-5-methylsulfonyloxycyclohexene-1-carboxylate
- 영어명
- (3R,4R,5R)-3,4-Dihydroxy-5-[(Methylsulfonyl)oxy]-1-cyclohexene-1-carboxylic Acid Ethyl Ester
- 분자식
- C10H16O7S
- 분자량
- 280.29
이름 및 동의어
220626-12-0ethyl (3R,4R,5R)-3,4-dihydroxy-5-methylsulfonyloxycyclohexene-1-carboxylate(3R,4R,5R)-3,4-Dihydroxy-5-[(methylsulfonyl)oxy]-1-cyclohexene-1-carboxylic Acid Ethyl EsterECK6S35V4FSCHEMBL24418101Ethyl (3R,4R,5R)-3,4-dihydroxy-5-((methylsulfonyl)oxy)cyclohex-1-ene-1-carboxylateCS-0164990(3R,4R,5R)-ethyl 3,4-dihydroxy-5-((methylsulfonyl)oxy)cyclohex-1-enecarboxylateEthyl (3R,4R,5R)-3,4-dihydroxy-5-[(methylsulfonyl)oxy]-1-cyclohexene-1-carboxylate(3R,4R,5R)-Ethyl 3,4-dihydroxy-5-(methylsulfonyloxy)cyclohex-1-enecarboxylate (Oseltamivir Impurity pound(c)1-Cyclohexene-1-carboxylic acid, 3,4-dihydroxy-5-[(methylsulfonyl)oxy]-, ethyl ester, (3R,4R,5R)-ethyl (3R,4R,5R)-3,4-dihydroxy-5-((methylsulfonyl)oxy) cyclohex-1-ene-1-carboxylate
이름 더 보기
(3R,4R,5R)-3,4-Dihydroxy-5-[(methylsulfonyl)oxy]-1-cyclohexene-1-carboxylic Acid Ethyl Ester (>85%)Oseltamivir?Impurity?32/(3R,4R,5R)-3,4-Dihydroxy-5-[(methylsulfonyl)oxy]-1-cyclohexene-1-carboxylic?acid?ethyl?ester
데이터베이스 식별자
- CAS
220626-12-0- PubChem CID
- 10684133
- UNII
- ECK6S35V4F
물성
구조 계산 물성
- XLogP
- -0.9
- 극성 표면적
- 119 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 434
물리화학적 성질
- 녹는점
- 89 °C · >89°C (dec.)
- 저장 조건
- -20 °C, · -20°C, Inert atmosphere
- 용해도
- DMSO(적게), 메탄올(약간), 물(약간)에 용해됨
- 물리적 상태
- 고체
- 색상
- 흰색에서 황백색까지
화학 및 산업
응용 분야
용도(3R,4R,5R)-3,4-Dihydroxy-5-[(methylsulfonyl)oxy]-1-cyclohexene-1-carboxylic Acid Ethyl Ester is an intermediate in the synthesis of neuraminidase inhibitors.
공급사17 곳
苏州道澜生物医药科技有限公司15952404857 · [email protected]
济南百隆化学有限公司[email protected] · [email protected]
南京正济医药研究有限公司0512-62750571 · [email protected]
上海尺水药物研究有限公司[email protected] 13564957716 · [email protected]
湖北扬信医药科技有限公司0714-3999001 19171453112 · [email protected]
大赛璐药物手性技术（上海）有限公司021-50460086-9 15921403865 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
合肥孚亚生物技术有限公司18096409024 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
易世明（北京）生物医药科技有限公司16600087706;18210486071 · [email protected]
南京正济医药研究有限公司0512-62750571 · [email protected]
南京贝开思医药科技有限公司+86-13912903754 13912903754 · [email protected]
上海择睿生物科技有限公司021-54580889 18321124657 · [email protected]
广州市震霖医药科技有限公司020-18102736 13622807357 · [email protected]
南京汉海征程医药科技有限公司15850673134 · [email protected]
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