Chem
J-GLOBAL ID:201307029435183388   Nikkaji number:J3.179.764K

2-Bromo-3-hydroxy-6-pentylbenzoic acid methyl ester

2-ブロモ-3-ヒドロキシ-6-ペンチル安息香酸メチル
Substance type:
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
Molecular formula: C13H17BrO3
Molecular formula furigana: C13-H17-BR-O3
Molecular weight: 301.180
InChI: InChI=1S/C13H17BrO3/c1-3-4-5-6-9-7-8-10(15)12(14)11(9)13(16)17-2/h7-8,15H,3-6H2,1-2H3
InChI key: HKADNUVATIKODS-UHFFFAOYSA-N
SMILES: CCCCCc1ccc(O)c(Br)c1C(=O)OC
Systematic name  (4):
  • 2-ブロモ-3-ヒドロキシ-6-ペンチル安息香酸メチル
  • 2-ペンチル-5-ヒドロキシ-6-ブロモ安息香酸メチル
  • メチル 2-ブロモ-3-ヒドロキシ-6-ペンチルベンゾアート
  • methyl 2-bromo-3-hydroxy-6-pentylbenzoate
Other name (2):
  • 2-Bromo-3-hydroxy-6-pentylbenzoic acid methyl ester
  • 2-Pentyl-5-hydroxy-6-bromobenzoic acid methyl ester
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