Tert-butyl cis-3-fluoro-4-(methylsulfonyloxy)piperidine-1-carboxylate

HCID 52324470

기본 정보

CAS
1313410-87-5
표준 SMILES
CC(C)(C)OC(=O)N1CC[C@H](OS(C)(=O)=O)[C@H](F)C1
InChIKey
IBRYORODRHGOCR-BDAKNGLRSA-N
분자식
C11H20FNO5S
평균 분자량
297.35 g/mol
단동위원소 질량
297.10462207

이름 및 식별자

우선 이름
Tert-butyl cis-3-fluoro-4-(methylsulfonyloxy)piperidine-1-carboxylate
IUPAC
tert-butyl (3R,4S)-3-fluoro-4-methylsulfonyloxypiperidine-1-carboxylate

이름 및 동의어

tert-butyl cis-3-fluoro-4-(methylsulfonyloxy)piperidine-1-carboxylate1313410-87-5tert-butyl (3R,4S)-3-fluoro-4-methylsulfonyloxypiperidine-1-carboxylate1-Piperidinecarboxylic acid, 3-fluoro-4-[(methylsulfonyl)oxy]-, 1,1-dimethylethyl ester, (3R,4S)-1070897-23-2SCHEMBL729879IBRYORODRHGOCR-BDAKNGLRSA-NDTXSID401115816(3R,4S)-tert-butyl 3-fluoro-4-(methylsulfonyloxy)piperidine-1-carboxylate(cis)-tert-butyl 3-fluoro-4-(methylsulfonyloxy)piperidine-1-carboxylate(3S,4R)-tert-Butyl 3-fluoro-4-((methylsulfonyl)oxy)piperidine-1-carboxylatetert-Butyl (3R,4S)-3-fluoro-4-[(methanesulfonyl)oxy]piperidine-1-carboxylate

데이터베이스 식별자

CAS
1313410-87-5
PubChem CID
52324470
DTXSID
DTXSID401115816

물성

구조 계산 물성

XLogP
1.1
극성 표면적
81.3 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
6
회전 가능 결합 수
4
무거운 원자 수
19

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6건

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