Chem
J-GLOBAL ID：200907027985363175
Nikkaji number：J12.273D
3,4,5-Trimethylbenzoic acid
3,4,5-トリメチル安息香酸
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： C10H12O2
Molecular formula furigana： C10-H12-O2
Molecular weight： 164.204
InChI：
InChI=1S/C10H12O2/c1-6-4-9(10(11)12)5-7(2)8(6)3/h4-5H,1-3H3,(H,11,12)
InChI key：
OWBVULKHVZHYPN-UHFFFAOYSA-N
SMILES：
Cc1cc(cc(C)c1C)C(=O)O
Systematic name (2)：
- 3,4,5-トリメチル安息香酸
- 3,4,5-trimethylbenzoic acid
- α-イソジュリル酸
- α-Isodurylic acid
- α-イソズリル酸
- α-イソデュリル酸
- 3,4,5-Trimethylbenzoic acid
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