Home Carboxys 5-(1H-1,2,3,4-tetrazol-1-yl)pyridine-2-carboxylic acid

5-(1H-1,2,3,4-tetrazol-1-yl)pyridine-2-carboxylic acid

CAS No.:
1433888-37-9
Catalog Number:
AG01C54I
Molecular Formula:
C7H5N5O2
Molecular Weight:
191.1469
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Product Description
Catalog Number:
AG01C54I
Chemical Name:
5-(1H-1,2,3,4-tetrazol-1-yl)pyridine-2-carboxylic acid
CAS Number:
1433888-37-9
Molecular Formula:
C7H5N5O2
Molecular Weight:
191.1469
MDL Number:
MFCD24149661
IUPAC Name:
5-(tetrazol-1-yl)pyridine-2-carboxylic acid
InChI:
InChI=1S/C7H5N5O2/c13-7(14)6-2-1-5(3-8-6)12-4-9-10-11-12/h1-4H,(H,13,14)
InChI Key:
JZBXKGRNDXEWGW-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cn1)n1cnnn1
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.044g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
191.15g/mol
Monoisotopic Mass:
191.044g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
93.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties