Home Carboxys Pyrazolo[1,5-a]pyrimidine-3-carboxylic acid, 5-methyl-

Pyrazolo[1,5-a]pyrimidine-3-carboxylic acid, 5-methyl-

CAS No.:
62908-85-4
Catalog Number:
AG00IB3V
Molecular Formula:
C8H7N3O2
Molecular Weight:
177.1601
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Product Description
Catalog Number:
AG00IB3V
Chemical Name:
Pyrazolo[1,5-a]pyrimidine-3-carboxylic acid, 5-methyl-
CAS Number:
62908-85-4
Molecular Formula:
C8H7N3O2
Molecular Weight:
177.1601
MDL Number:
MFCD16990654
IUPAC Name:
5-methylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid
InChI:
InChI=1S/C8H7N3O2/c1-5-2-3-11-7(10-5)6(4-9-11)8(12)13/h2-4H,1H3,(H,12,13)
InChI Key:
CADNVJNUYBVVFU-UHFFFAOYSA-N
SMILES:
Cc1ccn2c(n1)c(cn2)C(=O)O
Properties
Complexity:
221  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.054g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
177.163g/mol
Monoisotopic Mass:
177.054g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties