Chem
J-GLOBAL ID:200907048836538008   Nikkaji number:J886.063G

4-Methylbenzenesulfonic acid 2-methyl-3-phenyloxiranylmethyl ester

4-メチルベンゼンスルホン酸2-メチル-3-フェニルオキシラニルメチル
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: C17H18O4S
Molecular formula furigana: C17-H18-O4-S
Molecular weight: 318.390
InChI: InChI=1S/C17H18O4S/c1-13-8-10-15(11-9-13)22(18,19)20-12-17(2)16(21-17)14-6-4-3-5-7-14/h3-11,16H,12H2,1-2H3
InChI key: NXXJRLIWTUQPQA-UHFFFAOYSA-N
SMILES: Cc1ccc(cc1)S(=O)(=O)OCC1(C)OC1c1ccccc1
Systematic name  (3):
  • 4-メチルベンゼンスルホン酸2-メチル-3-フェニルオキシラニルメチル
  • (2-メチル-3-フェニルオキシラン-2-イル)メチル 4-メチルベンゼン-1-スルホナート
  • (2-methyl-3-phenyloxiran-2-yl)methyl 4-methylbenzene-1-sulfonate
Other name (1):
  • 4-Methylbenzenesulfonic acid 2-methyl-3-phenyloxiranylmethyl ester
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