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6973-52-0 | 4-Pyrimidinecarboxylicacid, 2-amino-1,6-dihydro-6-oxo-
CAS No: 6973-52-0 Catalog No: AG005IDE MDL No:MFCD11053039
Product Description
Catalog Number:
AG005IDE
Chemical Name:
4-Pyrimidinecarboxylicacid, 2-amino-1,6-dihydro-6-oxo-
CAS Number:
6973-52-0
Molecular Formula:
C5H5N3O3
Molecular Weight:
155.1115
MDL Number:
MFCD11053039
IUPAC Name:
2-amino-6-oxo-1H-pyrimidine-4-carboxylic acid
InChI:
InChI=1S/C5H5N3O3/c6-5-7-2(4(10)11)1-3(9)8-5/h1H,(H,10,11)(H3,6,7,8,9)
InChI Key:
XQYZBNZSWAVQJZ-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(=O)[nH]c(n1)N
UNII:
BNT4Y617LS
NSC Number:
40203
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.033g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
155.113g/mol
Monoisotopic Mass:
155.033g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.6
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