Home Carboxys 4-cyclopropyl-2-methylpyrimidine-5-carboxylic acid

4-cyclopropyl-2-methylpyrimidine-5-carboxylic acid

CAS No.:
954232-87-2
Catalog Number:
AG01B7VA
Molecular Formula:
C9H10N2O2
Molecular Weight:
178.1879
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Product Description
Catalog Number:
AG01B7VA
Chemical Name:
4-cyclopropyl-2-methylpyrimidine-5-carboxylic acid
CAS Number:
954232-87-2
Molecular Formula:
C9H10N2O2
Molecular Weight:
178.1879
MDL Number:
MFCD09750208
IUPAC Name:
4-cyclopropyl-2-methylpyrimidine-5-carboxylic acid
InChI:
InChI=1S/C9H10N2O2/c1-5-10-4-7(9(12)13)8(11-5)6-2-3-6/h4,6H,2-3H2,1H3,(H,12,13)
InChI Key:
AANXPDRKUMCFKJ-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc(nc1C1CC1)C
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