Home Nitriles 1-Acetyl-6-methyl-1H-indazole-3-carbonitrile

1-Acetyl-6-methyl-1H-indazole-3-carbonitrile

CAS No.:
1788043-95-7
Catalog Number:
AG00HZWM
Molecular Formula:
C11H9N3O
Molecular Weight:
199.2087
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Product Description
Catalog Number:
AG00HZWM
Chemical Name:
1-Acetyl-6-methyl-1H-indazole-3-carbonitrile
CAS Number:
1788043-95-7
Molecular Formula:
C11H9N3O
Molecular Weight:
199.2087
IUPAC Name:
1-acetyl-6-methylindazole-3-carbonitrile
InChI:
InChI=1S/C11H9N3O/c1-7-3-4-9-10(6-12)13-14(8(2)15)11(9)5-7/h3-5H,1-2H3
InChI Key:
AUUUEICCTRRBNR-UHFFFAOYSA-N
SMILES:
N#Cc1nn(c2c1ccc(c2)C)C(=O)C
Properties
Complexity:
319  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.075g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.213g/mol
Monoisotopic Mass:
199.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties