Chem
J-GLOBAL ID:200907002758182110   Nikkaji number:J1.657.989K

3β-(4-tert-Butylphenyl)oxirane-2α-carboxylic acid-2,6-di-tert-butyl-4-methylphenyl ester

3β-(4-tert-ブチルフェニル)オキシラン-2α-カルボン酸-2,6-ジ-tert-ブチル-4-メチルフェニル
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: C28H38O3
Molecular formula furigana: C28-H38-O3
Molecular weight: 422.609
InChI: InChI=1S/C28H38O3/c1-17-15-20(27(5,6)7)23(21(16-17)28(8,9)10)31-25(29)24-22(30-24)18-11-13-19(14-12-18)26(2,3)4/h11-16,22,24H,1-10H3/t22-,24+/m1/s1
InChI key: PQSQPQJBBPNNMB-VWNXMTODSA-N
SMILES: Cc1cc(c(OC(=O)[C@H]2O[C@@H]2c2ccc(cc2)C(C)(C)C)c(c1)C(C)(C)C)C(C)(C)C
Systematic name  (3):
  • 3β-(4-tert-ブチルフェニル)オキシラン-2α-カルボン酸-2,6-ジ-tert-ブチル-4-メチルフェニル
  • 2,6-ジ-tert-ブチル-4-メチルフェニル (2S,3R)-3-(4-tert-ブチルフェニル)オキシラン-2-カルボキシラート
  • 2,6-di-tert-butyl-4-methylphenyl (2S,3R)-3-(4-tert-butylphenyl)oxirane-2-carboxylate
Other name (1):
  • 3β-(4-tert-Butylphenyl)oxirane-2α-carboxylic acid-2,6-di-tert-butyl-4-methylphenyl ester
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