Chem
J-GLOBAL ID：200907010096326845
Nikkaji number：J1.439.127D
(2R,4R)-2,4-Di-tert-butoxy-1-(p-tolylthio)-5-phenylpentane
(2R,4R)-2,4-ジ-tert-ブトキシ-1-(p-トリルチオ)-5-フェニルペンタン
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： C26H38O2S
Molecular formula furigana： C26-H38-O2-S
Molecular weight： 414.650
InChI：
InChI=1S/C26H38O2S/c1-20-13-15-24(16-14-20)29-19-23(28-26(5,6)7)18-22(27-25(2,3)4)17-21-11-9-8-10-12-21/h8-16,22-23H,17-19H2,1-7H3/t22-,23-/m1/s1
InChI key：
GJSXHTCUVIQSRM-DHIUTWEWSA-N
SMILES：
Cc1ccc(SC[C@@H](C[C@@H](Cc2ccccc2)OC(C)(C)C)OC(C)(C)C)cc1
Systematic name (3)：
- (2R,4R)-2,4-ジ-tert-ブトキシ-1-(p-トリルチオ)-5-フェニルペンタン
- 1-{[(2R,4R)-2,4-ビス(tert-ブトキシ)-5-フェニルペンチル]スルファニル}-4-メチルベンゼン
- 1-{[(2R,4R)-2,4-bis(tert-butoxy)-5-phenylpentyl]sulfanyl}-4-methylbenzene
- (2R,4R)-2,4-Di-tert-butoxy-1-(p-tolylthio)-5-phenylpentane
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