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78316-08-2 | 3H-Imidazo[4,5-b]pyridine-7-carboxylic acid
CAS No: 78316-08-2 Catalog No: AG0039C4 MDL No:MFCD05723323
Product Description
Catalog Number:
AG0039C4
Chemical Name:
3H-Imidazo[4,5-b]pyridine-7-carboxylic acid
CAS Number:
78316-08-2
Molecular Formula:
C7H5N3O2
Molecular Weight:
163.1335
MDL Number:
MFCD05723323
IUPAC Name:
1H-imidazo[4,5-b]pyridine-7-carboxylic acid
InChI:
InChI=1S/C7H5N3O2/c11-7(12)4-1-2-8-6-5(4)9-3-10-6/h1-3H,(H,11,12)(H,8,9,10)
InChI Key:
CEZJOKOKGRAPMR-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccnc2c1nc[nH]2
NSC Number:
371788
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.038g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
163.136g/mol
Monoisotopic Mass:
163.038g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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