Home Carboxys 4-Pyrimidinecarboxylicacid, 5-methyl-

4-Pyrimidinecarboxylicacid, 5-methyl-

CAS No.:
933683-35-3
Catalog Number:
AG00IHJY
Molecular Formula:
C6H6N2O2
Molecular Weight:
138.1240
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Product Description
Catalog Number:
AG00IHJY
Chemical Name:
4-Pyrimidinecarboxylicacid, 5-methyl-
CAS Number:
933683-35-3
Molecular Formula:
C6H6N2O2
Molecular Weight:
138.1240
MDL Number:
MFCD11977462
IUPAC Name:
5-methylpyrimidine-4-carboxylic acid
InChI:
InChI=1S/C6H6N2O2/c1-4-2-7-3-8-5(4)6(9)10/h2-3H,1H3,(H,9,10)
InChI Key:
INTUWGJOBDUGLY-UHFFFAOYSA-N
SMILES:
OC(=O)c1ncncc1C
Properties
Complexity:
138  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.043g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
138.126g/mol
Monoisotopic Mass:
138.043g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties