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1261943-94-5 | [1,1'-Biphenyl]-3-carboxylic acid, 4-fluoro-2'-hydroxy-
CAS No: 1261943-94-5 Catalog No: AG000S87 MDL No:MFCD18319015
Product Description
Catalog Number:
AG000S87
Chemical Name:
[1,1'-Biphenyl]-3-carboxylic acid, 4-fluoro-2'-hydroxy-
CAS Number:
1261943-94-5
Molecular Formula:
C13H9FO3
Molecular Weight:
232.2072
MDL Number:
MFCD18319015
IUPAC Name:
2-fluoro-5-(2-hydroxyphenyl)benzoic acid
InChI:
InChI=1S/C13H9FO3/c14-11-6-5-8(7-10(11)13(16)17)9-3-1-2-4-12(9)15/h1-7,15H,(H,16,17)
InChI Key:
UEOSCVAEFKJFHN-UHFFFAOYSA-N
SMILES:
Oc1ccccc1c1ccc(c(c1)C(=O)O)F
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.054g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
232.21g/mol
Monoisotopic Mass:
232.054g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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