Chem
J-GLOBAL ID:200907016782439913   Nikkaji number:J930.562I

(2R,3R)-2,4-Dimethyl-4-(benzylthio)-1,3-pentanediol

(2R,3R)-2,4-ジメチル-4-(ベンジルチオ)-1,3-ペンタンジオール
Substance type:
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
Molecular formula: C14H22O2S
Molecular formula furigana: C14-H22-O2-S
Molecular weight: 254.390
InChI: InChI=1S/C14H22O2S/c1-11(9-15)13(16)14(2,3)17-10-12-7-5-4-6-8-12/h4-8,11,13,15-16H,9-10H2,1-3H3/t11-,13-/m1/s1
InChI key: MOEDMQIFEDLFCU-DGCLKSJQSA-N
SMILES: C[C@H](CO)[C@@H](O)C(C)(C)SCc1ccccc1
Systematic name  (3):
  • (2R,3R)-2,4-ジメチル-4-(ベンジルチオ)-1,3-ペンタンジオール
  • (2R,3R)-4-(ベンジルスルファニル)-2,4-ジメチルペンタン-1,3-ジオール
  • (2R,3R)-4-(benzylsulfanyl)-2,4-dimethylpentane-1,3-diol
Other name (1):
  • (2R,3R)-2,4-Dimethyl-4-(benzylthio)-1,3-pentanediol
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