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1215206-61-3 | [1,1'-Biphenyl]-3-carboxylic acid, 4'-hydroxy-3'-methoxy-
CAS No: 1215206-61-3 Catalog No: AG00157J MDL No:MFCD15143533
Product Description
Catalog Number:
AG00157J
Chemical Name:
[1,1'-Biphenyl]-3-carboxylic acid, 4'-hydroxy-3'-methoxy-
CAS Number:
1215206-61-3
Molecular Formula:
C14H12O4
Molecular Weight:
244.2427
MDL Number:
MFCD15143533
IUPAC Name:
3-(4-hydroxy-3-methoxyphenyl)benzoic acid
InChI:
InChI=1S/C14H12O4/c1-18-13-8-10(5-6-12(13)15)9-3-2-4-11(7-9)14(16)17/h2-8,15H,1H3,(H,16,17)
InChI Key:
CJSQCDOAVLQBRY-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1O)c1cccc(c1)C(=O)O
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.074g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
244.246g/mol
Monoisotopic Mass:
244.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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