Home Nitriles 3-methyl-1H-indazole-7-carbonitrile

3-methyl-1H-indazole-7-carbonitrile

CAS No.:
1554584-26-7
Catalog Number:
AG00IL5A
Molecular Formula:
C9H7N3
Molecular Weight:
157.1720
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Product Description
Catalog Number:
AG00IL5A
Chemical Name:
3-methyl-1H-indazole-7-carbonitrile
CAS Number:
1554584-26-7
Molecular Formula:
C9H7N3
Molecular Weight:
157.1720
MDL Number:
MFCD28605286
IUPAC Name:
3-methyl-2H-indazole-7-carbonitrile
InChI:
InChI=1S/C9H7N3/c1-6-8-4-2-3-7(5-10)9(8)12-11-6/h2-4H,1H3,(H,11,12)
InChI Key:
DLIAUGIKYWWOQV-UHFFFAOYSA-N
SMILES:
N#Cc1cccc2c1[nH]nc2C
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.064g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
157.176g/mol
Monoisotopic Mass:
157.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties