3,3,3-Trifluoro-2-hydroxy-2-({[(4-methylphenyl)sulfonyl]oxy}methyl)propyl 4-methylbenzenesulfonate

HCID 24809782

기본 정보

표준 SMILES
Cc1ccc(S(=O)(=O)OCC(O)(COS(=O)(=O)c2ccc(C)cc2)C(F)(F)F)cc1
InChIKey
WQMAUZSEYGFKPV-UHFFFAOYSA-N
분자식
C18H19F3O7S2
평균 분자량
468.5 g/mol

이름 및 식별자

우선 이름
3,3,3-Trifluoro-2-hydroxy-2-({[(4-methylphenyl)sulfonyl]oxy}methyl)propyl 4-methylbenzenesulfonate
IUPAC
[3,3,3-trifluoro-2-hydroxy-2-[(4-methylphenyl)sulfonyloxymethyl]propyl] 4-methylbenzenesulfonate

이름 및 동의어

3,3,3-Trifluoro-2-hydroxy-2-({[(4-methylphenyl)sulfonyl]oxy}methyl)propyl 4-methylbenzenesulfonateSCHEMBL4767693,3,3-trifluoro-2-hydroxy-2-({[(4-methyl phenyl) sulfonyl]oxy}methyl)propyl 4-methylbenzenesulfonate3,3,3-Trifluoro-2-hydroxy-2-({[(4-methylphenyl) sulfonyl]oxy}methyl)propyl 4-methylbenzenesulfonate

데이터베이스 식별자

PubChem CID
24809782
Nikkaji
J2.619.777E

물성

구조 계산 물성

XLogP
3.2
극성 표면적
124 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
10
회전 가능 결합 수
8
무거운 원자 수
30

관련 반응

6건

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