Chem
J-GLOBAL ID：200907078847092113
Nikkaji number：J1.732.454C
(α,α,α,4-2H4)Toluene
(α,α,α,4-2H4)トルエン
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： C7H4[2H]4
Molecular formula furigana： C7-H8
Molecular weight： 96.165
InChI：
InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3/i1D3,2D
InChI key：
YXFVVABEGXRONW-MZCSYVLQSA-N
SMILES：
c1([2H])ccc(cc1)C([2H])([2H])[2H]
Systematic name (3)：
- (α,α,α,4-2H4)トルエン
- 1-(2H3)メチル(4-2H)ベンゼン
- 1-(2H3)methyl(4-2H)benzene
- (α,α,α,4-2H4)Toluene
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