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1381944-41-7 | [1,1'-Biphenyl]-3-carboxylic acid, 2-fluoro-3'-(phenylmethoxy)-
CAS No: 1381944-41-7 Catalog No: AG001873 MDL No:MFCD22375079
Product Description
Catalog Number:
AG001873
Chemical Name:
[1,1'-Biphenyl]-3-carboxylic acid, 2-fluoro-3'-(phenylmethoxy)-
CAS Number:
1381944-41-7
Molecular Formula:
C20H15FO3
Molecular Weight:
322.3297
MDL Number:
MFCD22375079
IUPAC Name:
2-fluoro-3-(3-phenylmethoxyphenyl)benzoic acid
InChI:
InChI=1S/C20H15FO3/c21-19-17(10-5-11-18(19)20(22)23)15-8-4-9-16(12-15)24-13-14-6-2-1-3-7-14/h1-12H,13H2,(H,22,23)
InChI Key:
ZWXCDLKKNAIJMT-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc(c1F)c1cccc(c1)OCc1ccccc1
Properties
Complexity:
408
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.101g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
322.335g/mol
Monoisotopic Mass:
322.101g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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