Chem
J-GLOBAL ID：200907033004404551
Nikkaji number：J103.925C
5-Phenylpentanoic acid methyl ester
5-フェニルペンタン酸メチル
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： C12H16O2
Molecular formula furigana： C12-H16-O2
Molecular weight： 192.258
InChI：
InChI=1S/C12H16O2/c1-14-12(13)10-6-5-9-11-7-3-2-4-8-11/h2-4,7-8H,5-6,9-10H2,1H3
InChI key：
BNNWLDUOVGYRLY-UHFFFAOYSA-N
SMILES：
COC(=O)CCCCc1ccccc1
Systematic name (5)：
- 5-フェニルペンタン酸メチル
- ベンゼン吉草酸メチル
- 5-フェニル吉草酸メチル
- メチル 5-フェニルペンタノアート
- methyl 5-phenylpentanoate
- Benzenevaleric acid methyl ester
- 5-Phenylpentanoic acid methyl ester
- 5-Phenylvaleric acid methyl ester
Regulation number (1)：
- (3)-1730
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