Home Nitriles 2,5,6-trimethyl-3-oxo-2,3-dihydropyridazine-4-carbonitrile

2,5,6-trimethyl-3-oxo-2,3-dihydropyridazine-4-carbonitrile

CAS No.:
60296-04-0
Catalog Number:
AG019KXI
Molecular Formula:
C8H9N3O
Molecular Weight:
163.1766
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Product Description
Catalog Number:
AG019KXI
Chemical Name:
2,5,6-trimethyl-3-oxo-2,3-dihydropyridazine-4-carbonitrile
CAS Number:
60296-04-0
Molecular Formula:
C8H9N3O
Molecular Weight:
163.1766
MDL Number:
MFCD09802094
IUPAC Name:
2,5,6-trimethyl-3-oxopyridazine-4-carbonitrile
InChI:
InChI=1S/C8H9N3O/c1-5-6(2)10-11(3)8(12)7(5)4-9/h1-3H3
InChI Key:
CIZYZUBJNUBRNR-UHFFFAOYSA-N
SMILES:
N#Cc1c(C)c(C)nn(c1=O)C
Properties
Complexity:
343  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.075g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
163.18g/mol
Monoisotopic Mass:
163.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties