22991-05-5

Name 4-(3-chlorophenyl)butanoicacid
CAS 22991-05-5
Molecular Formula C10H11ClO2
MDL Number MFCD06810458
Molecular Weight 198.65
MOL File 22991-05-5.mol

Chemical Properties

Melting point  55-56 °C
Boiling point  323.0±17.0 °C(Predicted)
density  1.227±0.06 g/cm3(Predicted)
pka 4.73±0.10(Predicted)
InChI InChI=1S/C10H11ClO2/c11-9-5-1-3-8(7-9)4-2-6-10(12)13/h1,3,5,7H,2,4,6H2,(H,12,13)
InChIKey UKSCUPNTXJMPCO-UHFFFAOYSA-N
SMILES C1(CCCC(O)=O)=CC=CC(Cl)=C1

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