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88460-78-0 | 2-Furancarboxylic acid,5-(2-carboxyphenyl)-
CAS No: 88460-78-0 Catalog No: AG004F9F MDL No:
Product Description
Catalog Number:
AG004F9F
Chemical Name:
2-Furancarboxylic acid,5-(2-carboxyphenyl)-
CAS Number:
88460-78-0
Molecular Formula:
C12H8O5
Molecular Weight:
232.1889
IUPAC Name:
5-(2-carboxyphenyl)furan-2-carboxylic acid
InChI:
InChI=1S/C12H8O5/c13-11(14)8-4-2-1-3-7(8)9-5-6-10(17-9)12(15)16/h1-6H,(H,13,14)(H,15,16)
InChI Key:
WMUYPMCIAJSRIN-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(o1)c1ccccc1C(=O)O
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.037g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
232.191g/mol
Monoisotopic Mass:
232.037g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
87.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Literature
| Title | Journal |
|---|---|
| Metalloform-selective inhibition: synthesis and structure-activity analysis of Mn(II)-form-selective inhibitors of Escherichia coli methionine aminopeptidase. | Bioorganic & medicinal chemistry letters 20051215 |
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