Home Other Building Blocks 5-acetyl-3-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione

5-acetyl-3-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione

CAS No.:
858002-18-3
Catalog Number:
AG019YUD
Molecular Formula:
C7H8N2O3
Molecular Weight:
168.1500
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Product Description
Catalog Number:
AG019YUD
Chemical Name:
5-acetyl-3-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
CAS Number:
858002-18-3
Molecular Formula:
C7H8N2O3
Molecular Weight:
168.1500
MDL Number:
MFCD22369810
IUPAC Name:
5-acetyl-3-methyl-1H-pyrimidine-2,4-dione
InChI:
InChI=1S/C7H8N2O3/c1-4(10)5-3-8-7(12)9(2)6(5)11/h3H,1-2H3,(H,8,12)
InChI Key:
XPMBJDVXFAFVRP-UHFFFAOYSA-N
SMILES:
CC(=O)c1c[nH]c(=O)n(c1=O)C
Properties
Complexity:
293  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.053g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
168.152g/mol
Monoisotopic Mass:
168.053g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9  
Properties