Home Nitriles 4-Methylpyrimidine-2-carbonitrile

4-Methylpyrimidine-2-carbonitrile

CAS No.:
77768-02-6
Catalog Number:
AG003LQG
Molecular Formula:
C6H5N3
Molecular Weight:
119.1240
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG003LQG
Chemical Name:
4-Methylpyrimidine-2-carbonitrile
CAS Number:
77768-02-6
Molecular Formula:
C6H5N3
Molecular Weight:
119.1240
MDL Number:
MFCD13190572
IUPAC Name:
4-methylpyrimidine-2-carbonitrile
InChI:
InChI=1S/C6H5N3/c1-5-2-3-8-6(4-7)9-5/h2-3H,1H3
InChI Key:
XXQWGLMZNGIYQY-UHFFFAOYSA-N
SMILES:
Cc1ccnc(n1)C#N
Properties
Complexity:
135  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
119.048g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
119.127g/mol
Monoisotopic Mass:
119.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties