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159211-24-2 | 2,4(1H,3H)-Pyrimidinedione, 5-hydroxy-1,6-dimethyl-
CAS No: 159211-24-2 Catalog No: AG001QK1 MDL No:MFCD01759074
Product Description
Catalog Number:
AG001QK1
Chemical Name:
2,4(1H,3H)-Pyrimidinedione, 5-hydroxy-1,6-dimethyl-
CAS Number:
159211-24-2
Molecular Formula:
C6H8N2O3
Molecular Weight:
156.1393
MDL Number:
MFCD01759074
IUPAC Name:
5-hydroxy-1,6-dimethylpyrimidine-2,4-dione
InChI:
InChI=1S/C6H8N2O3/c1-3-4(9)5(10)7-6(11)8(3)2/h9H,1-2H3,(H,7,10,11)
InChI Key:
FWSJXUFXMIGDAQ-UHFFFAOYSA-N
SMILES:
O=c1[nH]c(=O)c(c(n1C)C)O
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.053g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
156.141g/mol
Monoisotopic Mass:
156.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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