Home Carboxys 2-cyclobutyl-6-oxo-1,6-dihydropyrimidine-5-carboxylic acid

2-cyclobutyl-6-oxo-1,6-dihydropyrimidine-5-carboxylic acid

CAS No.:
1479852-60-2
Catalog Number:
AG01BT33
Molecular Formula:
C9H10N2O3
Molecular Weight:
194.1873
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Product Description
Catalog Number:
AG01BT33
Chemical Name:
2-cyclobutyl-6-oxo-1,6-dihydropyrimidine-5-carboxylic acid
CAS Number:
1479852-60-2
Molecular Formula:
C9H10N2O3
Molecular Weight:
194.1873
MDL Number:
MFCD21117883
IUPAC Name:
2-cyclobutyl-6-oxo-1H-pyrimidine-5-carboxylic acid
InChI:
InChI=1S/C9H10N2O3/c12-8-6(9(13)14)4-10-7(11-8)5-2-1-3-5/h4-5H,1-3H2,(H,13,14)(H,10,11,12)
InChI Key:
WEWUNSFPVIQZFI-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc([nH]c1=O)C1CCC1
Properties
Complexity:
353  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.069g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
194.19g/mol
Monoisotopic Mass:
194.069g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties