(S)-methyl 2-(4-(2-chlorophenoxy)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl)-4-methylpentanoate

HCID 57346985
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기본 정보

CAS
1191997-63-3
표준 SMILES
COC(=O)[C@H](CC(C)C)N1CC(Oc2ccccc2Cl)=CC1=O
InChIKey
BMVAWDBPBCLLQQ-AWEZNQCLSA-N
분자식
C17H20ClNO4
평균 분자량
337.8 g/mol
단동위원소 질량
337.1080858

이름 및 식별자

우선 이름
(S)-methyl 2-(4-(2-chlorophenoxy)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl)-4-methylpentanoate
IUPAC
methyl (2S)-2-[3-(2-chlorophenoxy)-5-oxo-2H-pyrrol-1-yl]-4-methylpentanoate
영어명
(S)-methyl 2-(4-(2-chlorophenoxy)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl)-4-methylpentanoate
분자식
C17H20ClNO4
분자량
337.8

이름 및 동의어

1191997-63-3(S)-methyl 2-(4-(2-chlorophenoxy)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl)-4-methylpentanoatemethyl (2S)-2-[3-(2-chlorophenoxy)-5-oxo-2H-pyrrol-1-yl]-4-methylpentanoate1H-Pyrrole-1-acetic acid, 4-(2-chlorophenoxy)-2,5-dihydro-alpha-(2-methylpropyl)-2-oxo-, methyl ester, (alphaS)-SCHEMBL1064483DTXSID10721315BMVAWDBPBCLLQQ-AWEZNQCLSA-NAKOS015995077methyl (S)-2-(4-(2-chlorophenoxy)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl)-4-methylpentanoate(S)-2-[4-(2-chloro-phenoxy)-2-oxo-2,5-dihydro-pyrrol-1-yl]-4-methyl-pentanoic acid methyl esterDB-353679(S)-methyl-2-(4-(2-chlorophenoxy)-2-oxo-2,5-dihydro-1h-pyrrol-1-yl)-4-methylpentan oate
이름 더 보기
methyl(S)-2-(4-(2-chlorophenoxy)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl)-4-methylpentanoate1H-Pyrrole-1-acetic acid, 4-(2-chlorophenoxy)-2,5-dihydro-α-(2-methylpropyl)-2-oxo-, methyl ester, (αS)-(alphaS)-4-(2-Chlorophenoxy)-2,5-dihydro-alpha-(2-methylpropyl)-2-oxo-1H-pyrrole-1-acetic acid methyl ester
Methyl (2S)-2-[4-(2-chlorophenoxy)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl]-4-methylpentanoate

데이터베이스 식별자

CAS
1191997-63-3
PubChem CID
57346985
DTXSID
DTXSID10721315

물성

구조 계산 물성

XLogP
3.3
극성 표면적
55.8 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
4
회전 가능 결합 수
7
무거운 원자 수
23

물리화학적 성질

밀도
1.246 · 1.246±0.06 g/cm3 (20 ºC 760 Torr)

화학 및 산업

공급사6 곳

凯美赛尔生物医药有限公司020-13556033878 2965585218 13556033878 · [email protected]
上海遐瑞医药科技有限公司+86 21 61551611
Xunteng International Trading Co.,Limited—
德州博腾精细化工有限公司[email protected]
德州朗维医药科技有限公司13761310616 · [email protected]

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