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Concept information

organooxygen compound > carbonyl compound > carboxylic acid > monocarboxylic acid > 2-(4-chlorophenyl)-3-methylbutyric acid

Preferred term

2-(4-chlorophenyl)-3-methylbutyric acid  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C11H13ClO2

has_functional_parent

inchi

  • InChI=1S/C11H13ClO2/c1-7(2)10(11(13)14)8-3-5-9(12)6-4-8/h3-7,10H,1-2H3,(H,13,14)

inchikey

  • VTJMSIIXXKNIDJ-UHFFFAOYSA-N

mass

  • 212.67242

monoisotopicmass

  • 212.06041

smiles

  • CC(C)C(C(O)=O)c1ccc(Cl)cc1

subset

  • 3_STAR

synonym EXACT

  • 2-(4-chlorophenyl)-3-methylbutanoic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:39345

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