4-(3-Fluoro-4-methoxyphenyl)phenylacetic acid - CAS 1334500-08-1

Catalog:	BB064992
Product Name:	4-(3-Fluoro-4-methoxyphenyl)phenylacetic acid
CAS:	1334500-08-1
Synonyms:	4-(3-Fluoro-4-methoxyphenyl)phenylacetic acid; 2-(3'-Fluoro-4'-methoxy-[1,1'-biphenyl]-4-yl)acetic acid; 2-[4-(3-fluoro-4-methoxyphenyl)phenyl]acetic acid; 2-(3'-Fluoro-4'-methoxy-[1,1'-biphenyl]-4-yl)aceticacid

Technical Data

Computed Properties

IUPAC Name:	2-[4-(3-fluoro-4-methoxyphenyl)phenyl]acetic acid
Description:	4-(3-Fluoro-4-methoxyphenyl)phenylacetic acid
Molecular Weight:	260.26
Molecular Formula:	C15H13FO3
Canonical SMILES:	COC1=C(C=C(C=C1)C2=CC=C(C=C2)CC(=O)O)F
InChI:	InChI=1S/C15H13FO3/c1-19-14-7-6-12(9-13(14)16)11-4-2-10(3-5-11)8-15(17)18/h2-7,9H,8H2,1H3,(H,17,18)
InChI Key:	WRPFETSVTXXKIL-UHFFFAOYSA-N

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Complexity:	300
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	260.08487243
Formal Charge:	0
Heavy Atom Count:	19
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	260.08487243
Rotatable Bond Count:	4
Topological Polar Surface Area:	46.5Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.1