Chem
J-GLOBAL ID：200907045969723534   Nikkaji number：J60.509C

Phthalic acid 1-isobutyl ester

フタル酸1-イソブチル
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： C12H14O4
Molecular formula furigana： C12-H14-O4
Molecular weight： 222.240
InChI： InChI=1S/C12H14O4/c1-8(2)7-16-12(15)10-6-4-3-5-9(10)11(13)14/h3-6,8H,7H2,1-2H3,(H,13,14)
InChI key： RZJSUWQGFCHNFS-UHFFFAOYSA-N
SMILES： CC(C)COC(=O)c1ccccc1C(=O)O
Systematic name  (5)：
  • フタル酸水素1-イソブチル
  • フタル酸1-イソブチル
  • フタル酸1-(2-メチルプロピル)
  • 2-[(2-メチルプロポキシ)カルボニル]安息香酸
  • 2-[(2-methylpropoxy)carbonyl]benzoic acid
Other name (4)：
  • MIBP
  • Phthalic acid hydrogen 1-isobutyl ester
  • Phthalic acid 1-isobutyl ester
  • Phthalic acid 1-(2-methylpropyl) ester
CAS registry number： 30833-53-5
Regulation number (3)：
  • TI2550000
  • EINECS2503526
  • (3)-1308
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