Home Halogens 2-chloro-N,6-dimethylpyrimidine-4-carboxamide

2-chloro-N,6-dimethylpyrimidine-4-carboxamide

CAS No.:
1201657-29-5
Catalog Number:
AG01DYHF
Molecular Formula:
C7H8ClN3O
Molecular Weight:
185.6109
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Product Description
Catalog Number:
AG01DYHF
Chemical Name:
2-chloro-N,6-dimethylpyrimidine-4-carboxamide
CAS Number:
1201657-29-5
Molecular Formula:
C7H8ClN3O
Molecular Weight:
185.6109
MDL Number:
MFCD20441076
IUPAC Name:
2-chloro-N,6-dimethylpyrimidine-4-carboxamide
InChI:
InChI=1S/C7H8ClN3O/c1-4-3-5(6(12)9-2)11-7(8)10-4/h3H,1-2H3,(H,9,12)
InChI Key:
VXDUVRFGTXTIOF-UHFFFAOYSA-N
SMILES:
CNC(=O)c1cc(C)nc(n1)Cl
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.036g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
185.611g/mol
Monoisotopic Mass:
185.036g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties