Home Carboxys 1,4-dimethyl-6-oxo-1,6-dihydropyrimidine-5-carboxylic acid

1,4-dimethyl-6-oxo-1,6-dihydropyrimidine-5-carboxylic acid

CAS No.:
2138515-47-4
Catalog Number:
AG01EKWE
Molecular Formula:
C7H8N2O3
Molecular Weight:
168.1500
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01EKWE
Chemical Name:
1,4-dimethyl-6-oxo-1,6-dihydropyrimidine-5-carboxylic acid
CAS Number:
2138515-47-4
Molecular Formula:
C7H8N2O3
Molecular Weight:
168.1500
MDL Number:
MFCD31601803
IUPAC Name:
1,4-dimethyl-6-oxopyrimidine-5-carboxylic acid
InChI:
InChI=1S/C7H8N2O3/c1-4-5(7(11)12)6(10)9(2)3-8-4/h3H,1-2H3,(H,11,12)
InChI Key:
QCZOEARKGFXQAZ-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(C)ncn(c1=O)C
Properties
Complexity:
304  
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:
4  
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:
70A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties