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Home > Indoles and Oxindole > 88251-63-2
88251-63-2 | 2H-Isoindole-1-carbonitrile, 2-methyl-
CAS No: 88251-63-2 Catalog No: AG004CH8 MDL No:
Product Description
Catalog Number:
AG004CH8
Chemical Name:
2H-Isoindole-1-carbonitrile, 2-methyl-
CAS Number:
88251-63-2
Molecular Formula:
C10H8N2
Molecular Weight:
156.1839
IUPAC Name:
2-methylisoindole-1-carbonitrile
InChI:
InChI=1S/C10H8N2/c1-12-7-8-4-2-3-5-9(8)10(12)6-11/h2-5,7H,1H3
InChI Key:
MILFMFBREMHXEQ-UHFFFAOYSA-N
SMILES:
N#Cc1n(C)cc2c1cccc2
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
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