Chem
J-GLOBAL ID：200907081457186215
Nikkaji number：J2.180.881D
Benzene(4,4-2H2)butyric acid
ベンゼン(4,4-2H2)酪酸
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： C10H10[2H]2O2
Molecular formula furigana： C10-H12-O2
Molecular weight： 166.216
InChI：
InChI=1S/C10H12O2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,11,12)/i7D2
InChI key：
OBKXEAXTFZPCHS-RJSZUWSASA-N
SMILES：
C([2H])([2H])(CCC(=O)O)c1ccccc1
Systematic name (3)：
- ベンゼン(4,4-2H2)酪酸
- 4-フェニル(4,4-2H2)ブタン酸
- 4-phenyl(4,4-2H2)butanoic acid
- Benzene(4,4-2H2)butyric acid
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