Home Nitriles 4-Methoxy-2-methylpyrimidine-5-carbonitrile

4-Methoxy-2-methylpyrimidine-5-carbonitrile

CAS No.:
2006-00-0
Catalog Number:
AG00BV27
Molecular Formula:
C7H7N3O
Molecular Weight:
149.1500
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Product Description
Catalog Number:
AG00BV27
Chemical Name:
4-Methoxy-2-methylpyrimidine-5-carbonitrile
CAS Number:
2006-00-0
Molecular Formula:
C7H7N3O
Molecular Weight:
149.1500
MDL Number:
MFCD18377705
IUPAC Name:
4-methoxy-2-methylpyrimidine-5-carbonitrile
InChI:
InChI=1S/C7H7N3O/c1-5-9-4-6(3-8)7(10-5)11-2/h4H,1-2H3
InChI Key:
LXZBFZOIXGRGLN-UHFFFAOYSA-N
SMILES:
COc1nc(C)ncc1C#N
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.059g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
149.153g/mol
Monoisotopic Mass:
149.059g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
58.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties