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138473-86-6 | [1,1'-Biphenyl]-3-carboxylic acid, 2',4'-difluoro-4,5-dihydroxy-
CAS No: 138473-86-6 Catalog No: AG00198M MDL No:
Product Description
Catalog Number:
AG00198M
Chemical Name:
[1,1'-Biphenyl]-3-carboxylic acid, 2',4'-difluoro-4,5-dihydroxy-
CAS Number:
138473-86-6
Molecular Formula:
C13H8F2O4
Molecular Weight:
266.1970
IUPAC Name:
5-(2,4-difluorophenyl)-2,3-dihydroxybenzoic acid
InChI:
InChI=1S/C13H8F2O4/c14-7-1-2-8(10(15)5-7)6-3-9(13(18)19)12(17)11(16)4-6/h1-5,16-17H,(H,18,19)
InChI Key:
CFMLSPVNKGETAQ-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)F)c1cc(O)c(c(c1)C(=O)O)O
Properties
Complexity:
339
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.039g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
266.2g/mol
Monoisotopic Mass:
266.039g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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