Chem
J-GLOBAL ID：200907074349195880   Nikkaji number：J1.373.591C

1,3-Bis(isothiocyanatomethyl)-2,4,6-triethylbenzene

1,3-ビス(イソチオシアナトメチル)-2,4,6-トリエチルベンゼン
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： C16H20N2S2
Molecular formula furigana： C16-H20-N2-S2
Molecular weight： 304.470
InChI： InChI=1S/C16H20N2S2/c1-4-12-7-13(5-2)16(9-18-11-20)14(6-3)15(12)8-17-10-19/h7H,4-6,8-9H2,1-3H3
InChI key： IOJJMVIXORBEKQ-UHFFFAOYSA-N
SMILES： CCc1cc(CC)c(CN=C=S)c(CC)c1CN=C=S
Systematic name  (3)：
  • 1,3-ビス(イソチオシアナトメチル)-2,4,6-トリエチルベンゼン
  • 1,3,5-トリエチル-2,4-ビス(イソチオシアナトメチル)ベンゼン
  • 1,3,5-triethyl-2,4-bis(isothiocyanatomethyl)benzene
Other name (1)：
  • 1,3-Bis(isothiocyanatomethyl)-2,4,6-triethylbenzene
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