Home Carboxys 2-Cyclopropyl-4-methyl-pyrimidine-5-carboxylic acid

2-Cyclopropyl-4-methyl-pyrimidine-5-carboxylic acid

CAS No.:
954233-05-7
Catalog Number:
AG0060AM
Molecular Formula:
C9H10N2O2
Molecular Weight:
178.1879
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Product Description
Catalog Number:
AG0060AM
Chemical Name:
2-Cyclopropyl-4-methyl-pyrimidine-5-carboxylic acid
CAS Number:
954233-05-7
Molecular Formula:
C9H10N2O2
Molecular Weight:
178.1879
MDL Number:
MFCD09750211
IUPAC Name:
2-cyclopropyl-4-methylpyrimidine-5-carboxylic acid
InChI:
InChI=1S/C9H10N2O2/c1-5-7(9(12)13)4-10-8(11-5)6-2-3-6/h4,6H,2-3H2,1H3,(H,12,13)
InChI Key:
BSLXWOKIRNVYGN-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc(nc1C)C1CC1
Properties
Complexity:
216  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.074g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
178.191g/mol
Monoisotopic Mass:
178.074g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties