Chem
J-GLOBAL ID：200907003834703610
Nikkaji number：J391.013J
Benzoic acid 4-hydroxybenzyl ester
安息香酸4-ヒドロキシベンジル
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： C14H12O3
Molecular formula furigana： C14-H12-O3
Molecular weight： 228.247
InChI：
InChI=1S/C14H12O3/c15-13-8-6-11(7-9-13)10-17-14(16)12-4-2-1-3-5-12/h1-9,15H,10H2
InChI key：
SBQBDPDANAWBBG-UHFFFAOYSA-N
SMILES：
Oc1ccc(COC(=O)c2ccccc2)cc1
Systematic name (3)：
- 安息香酸4-ヒドロキシベンジル
- (4-ヒドロキシフェニル)メチル ベンゾアート
- (4-hydroxyphenyl)methyl benzoate
- Benzoic acid 4-hydroxybenzyl ester
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