Chem
J-GLOBAL ID：200907008285189510
Nikkaji number：J470.952G
(S)-2-(Benzyloxy)-3,3-difluoro-1-(p-tolylsulfinyl)butane
(S)-2-(ベンジルオキシ)-3,3-ジフルオロ-1-(p-トリルスルフィニル)ブタン
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C18H20F2O2S
Molecular formula furigana： C18-H20-F2-O2-S
Molecular weight： 338.410
InChI：
InChI=1S/C18H20F2O2S/c1-14-8-10-16(11-9-14)23(21)13-17(18(2,19)20)22-12-15-6-4-3-5-7-15/h3-11,17H,12-13H2,1-2H3/t17-,23?/m1/s1
InChI key：
IGHNVEJTBYBWRS-LIXIDFRTSA-N
SMILES：
Cc1ccc(cc1)S(=O)C[C@@H](OCc1ccccc1)C(C)(F)F
Systematic name (3)：
- (S)-2-(ベンジルオキシ)-3,3-ジフルオロ-1-(p-トリルスルフィニル)ブタン
- 1-[(2S)-2-(ベンジルオキシ)-3,3-ジフルオロブタンスルフィニル]-4-メチルベンゼン
- 1-[(2S)-2-(benzyloxy)-3,3-difluorobutanesulfinyl]-4-methylbenzene
- (S)-2-(Benzyloxy)-3,3-difluoro-1-(p-tolylsulfinyl)butane
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