기본 정보
- CAS
312904-18-0- 표준 SMILES
C=CCN[C@H]1CC(C(=O)OCC)=C[C@@H](OC(CC)CC)[C@@H]1NC(C)=O- InChIKey
YAYJVAVBLBKVLR-RCCFBDPRSA-N- 분자식
- C19H32N2O4
- 평균 분자량
- 352.5 g/mol
- 단동위원소 질량
- 352.23620751
이름 및 식별자
- 우선 이름
- ethyl (3R,4R,5S)-4-acetamido-5-(allylamino)-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylate
- IUPAC
- ethyl (3R,4R,5S)-4-acetamido-3-pentan-3-yloxy-5-(prop-2-enylamino)cyclohexene-1-carboxylate
- 영어명
- 312904-18-0
- 분자식
- C19H32N2O4
- 분자량
- 352.47
이름 및 동의어
312904-18-0Oseltamivir Impurity 90ethyl (3R,4R,5S)-4-acetamido-5-(allylamino)-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylateEthyl (3R,4R,5S)-4-acetamido-3-pentan-3-yloxy-5-(prop-2-enylamino)cyclohexene-1-carboxylate(3r,4r,5s)-4-acetylamino-5-allylamino-3-(1-ethyl-propoxy)-cyclohex-1-enecarboxylic acid ethyl ester(3R,4R,5S)-ethyl 4-acetamido-5-(allylamino)-3-(pentan-3-yloxy)cyclohex-1-enecarboxylateEthyl (3R,4R,5S)-4-(acetylamino)-3-(1-ethylpropoxy)-5-(2-propen-1-ylamino)-1-cyclohexene-1-carboxylateJGQ3BTA9FUSCHEMBL973660YAYJVAVBLBKVLR-RCCFBDPRSA-Nethyl (3R,4R,5S)-4-acetamido-3-(pentan-3-yloxy)-5-[(prop-2-en-1-yl)amino]cyclohex-1-ene-1-carboxylate(3R,4R,5S)-4-(acetylamino)-3-(l-ethylrhororhooxy)-5-(2-rhoropenylamino)-l-cyclohexene-1-carboxylic acid ethyl ester
이름 더 보기
Oseltamivir Impurity 195Oseltamivir Impurity VIIIStandard product of Oseltamivir phosphate intermediate S001P02ethyl (3R,4R,5S)-4-acetamido-5-(allylamino)-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylateQ: What is ethyl (3R,4R,5S)-4-acetamido-5-(allylamino)-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylate Q: What is the CAS Number of ethyl (3R,4R,5S)-4-acetamido-5-(allylamino)-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylate
1-Cyclohexene-1-carboxylic acid, 4-(acetylamino)-3-(1-ethylpropoxy)-5-(2-propen-1-ylamino)-, ethyl ester, (3R,4R,5S)-1-Cyclohexene-1-carboxylic acid, 4-(acetylamino)-3-(1-ethylpropoxy)-5-(2-propenylamino)-, ethyl ester, (3R,4R,5S)-
데이터베이스 식별자
- CAS
312904-18-0- PubChem CID
- 10784209
- UNII
- JGQ3BTA9FU
물성
구조 계산 물성
- XLogP
- 2.3
- 극성 표면적
- 76.7 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 11
- 무거운 원자 수
- 25
- 형식 전하
- 0
- 복잡도
- 486
물리화학적 성질
- 녹는점
- 100 · 100-104 °C
- 끓는 점
- 507.6 · 507.6±50.0 °C(Predicted)
- 밀도
- 1.05 · 1.05±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 14.71 · 14.71±0.70(Predicted)
화학 및 산업
공급사21 곳
济南百隆化学有限公司[email protected] · [email protected]
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
山东沃德森生物科技有限公司0531-88723173 18596073690 · [email protected]
上海尺水药物研究有限公司[email protected] 13564957716 · [email protected]
大赛璐药物手性技术（上海）有限公司021-50460086-9 15921403865 · [email protected]
Moxin Chemicals+86-17320513646 +86-17320513646 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
湖北扬信医药科技有限公司15347293736 · [email protected]
常州翔龙医药科技有限公司18915873328 18915873328 · [email protected]
坛墨质检科技股份有限公司19850211281 · [email protected]
苏州美石生物科技有限公司1173954148q · [email protected]
湖北扬信医药科技有限公司07143299675 13092790750 · [email protected]
湖北摩科生物科技有限公司18274848843 · [email protected]
广州佳途科技股份有限公司020-81960175-877 18933936954 · [email protected]
深圳博泰尔生物技术有限公司13316949107 13316968096 · [email protected]
江苏万思普科技有限公司17826022701 · [email protected]
湖北摩科生物科技有限公司17320513646 · [email protected]
上海择睿生物科技有限公司021-54580889 18321124657 · [email protected]
湖北清北云研医药科技有限责任公司18162595016; 18162595016 · [email protected]
山东子易医药有限公司13173053288 · [email protected]
南京汉海征程医药科技有限公司15850673134 · [email protected]
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