CAS
914223-80-6 Purity
96%
914223-80-6 Purity
96%
If you have any other questions or need other size, please get a quote.
Specification
The molecular formula is C8H8FNO2.
It was created on 2007-12-04 and last modified on 2023-12-30.
The IUPAC name is 2-(4-amino-2-fluorophenyl)acetic acid.
The InChI is InChI=1S/C8H8FNO2/c9-7-4-6(10)2-1-5(7)3-8(11)12/h1-2,4H,3,10H2,(H,11,12).
The InChIKey is OENIGBRUGRNUDR-UHFFFAOYSA-N.
The Canonical SMILES is C1=CC(=C(C=C1N)F)CC(=O)O.
The molecular weight is 169.15 g/mol.
It has 2 hydrogen bond donor counts.
The topological polar surface area is 63.3 Å2.
Yes, the compound is canonicalized.