tert-Butyl (4S)-4-(4-(trifluoromethyl)benzyl)-1,2,3-oxathiazolidine-3-carboxylate 2,2-dioxide

HCID 57634052

기본 정보

표준 SMILES
CC(C)(C)OC(=O)N1[C@@H](Cc2ccc(C(F)(F)F)cc2)COS1(=O)=O
InChIKey
NASHXMFMSHZCQF-LBPRGKRZSA-N
분자식
C15H18F3NO5S
평균 분자량
381.4 g/mol

이름 및 식별자

우선 이름
tert-Butyl (4S)-4-(4-(trifluoromethyl)benzyl)-1,2,3-oxathiazolidine-3-carboxylate 2,2-dioxide
IUPAC
tert-butyl (4S)-2,2-dioxo-4-[[4-(trifluoromethyl)phenyl]methyl]oxathiazolidine-3-carboxylate

이름 및 동의어

tert-Butyl (4S)-4-(4-(trifluoromethyl)benzyl)-1,2,3-oxathiazolidine-3-carboxylate 2,2-dioxidetert-butyl (4S)-4-[4-(trifluoromethyl)benzyl]-1,2,3-oxathiazolidine-3-carboxylate 2,2-dioxideSCHEMBL1519808(S)-tert-Butyl 4-(4-(trifluoromethyl)benzyl)-1,2,3-oxathiazolidine-3-carboxylate-2,2-dioxide1,1-dimethylethyl (4S)-4-((4-(trifluoromethyl)phenyl)methyl)-1,2,3-oxathiazolidine-3-carboxylate 2,2-dioxide

데이터베이스 식별자

PubChem CID
57634052

물성

구조 계산 물성

XLogP
3.4
극성 표면적
81.3 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
8
회전 가능 결합 수
4
무거운 원자 수
25

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7건

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