CAS
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Specification
The molecular formula is C12H13FO2.
The molecular weight is 208.23 g/mol.
It was created on July 8, 2005.
It was last modified on December 2, 2023.
The IUPAC name is 1-(3-fluorophenyl)cyclopentane-1-carboxylic acid.
The InChI is InChI=1S/C12H13FO2/c13-10-5-3-4-9(8-10)12(11(14)15)6-1-2-7-12/h3-5,8H,1-2,6-7H2,(H,14,15).
The InChIKey is RLAKVCCLVVITLS-UHFFFAOYSA-N.
The canonical SMILES is C1CCC(C1)(C2=CC(=CC=C2)F)C(=O)O.
The CAS number is 214262-97-2.
The XLogP3-AA value is 2.9.