Home Carboxys 6-hydroxy-2-methoxypyrimidine-4-carboxylic acid

6-hydroxy-2-methoxypyrimidine-4-carboxylic acid

CAS No.:
1123546-30-4
Catalog Number:
AG01E94S
Molecular Formula:
C6H6N2O4
Molecular Weight:
170.1228
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Product Description
Catalog Number:
AG01E94S
Chemical Name:
6-hydroxy-2-methoxypyrimidine-4-carboxylic acid
CAS Number:
1123546-30-4
Molecular Formula:
C6H6N2O4
Molecular Weight:
170.1228
MDL Number:
MFCD20647746
IUPAC Name:
2-methoxy-6-oxo-1H-pyrimidine-4-carboxylic acid
InChI:
InChI=1S/C6H6N2O4/c1-12-6-7-3(5(10)11)2-4(9)8-6/h2H,1H3,(H,10,11)(H,7,8,9)
InChI Key:
ZXIMJWDECSGSPN-UHFFFAOYSA-N
SMILES:
COc1nc(O)cc(n1)C(=O)O
Properties
Complexity:
292  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.033g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
170.124g/mol
Monoisotopic Mass:
170.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
88A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  
Properties