Home Nitriles 1H-Indole-2-carbonitrile,1-methyl-

1H-Indole-2-carbonitrile,1-methyl-

CAS No.:
60680-97-9
Catalog Number:
AG00E998
Molecular Formula:
C10H8N2
Molecular Weight:
156.1839
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Product Description
Catalog Number:
AG00E998
Chemical Name:
1H-Indole-2-carbonitrile,1-methyl-
CAS Number:
60680-97-9
Molecular Formula:
C10H8N2
Molecular Weight:
156.1839
MDL Number:
MFCD09263865
IUPAC Name:
1-methylindole-2-carbonitrile
InChI:
InChI=1S/C10H8N2/c1-12-9(7-11)6-8-4-2-3-5-10(8)12/h2-6H,1H3
InChI Key:
JOCOGYNDZDYYOS-UHFFFAOYSA-N
SMILES:
N#Cc1cc2c(n1C)cccc2
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.069g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.188g/mol
Monoisotopic Mass:
156.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties