Chem
J-GLOBAL ID：200907042893172143
Nikkaji number：J1.076.318E
5-Bromo-2-phenylpentanoic acid methyl ester
5-ブロモ-2-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： C12H15BrO2
Molecular formula furigana： C12-H15-BR-O2
Molecular weight： 271.154
InChI：
InChI=1S/C12H15BrO2/c1-15-12(14)11(8-5-9-13)10-6-3-2-4-7-10/h2-4,6-7,11H,5,8-9H2,1H3
InChI key：
CQZNBTWOTWTUES-UHFFFAOYSA-N
SMILES：
COC(=O)C(CCCBr)c1ccccc1
Systematic name (3)：
- 5-ブロモ-2-フェニルペンタン酸メチル
- メチル 5-ブロモ-2-フェニルペンタノアート
- methyl 5-bromo-2-phenylpentanoate
- 5-Bromo-2-phenylpentanoic acid methyl ester
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