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Home > Indoles and Oxindole > 263888-58-0
263888-58-0 | 1H-Isoindole-5-carbonitrile, 2,3-dihydro-
CAS No: 263888-58-0 Catalog No: AG002SZV MDL No:MFCD08234858
Product Description
Catalog Number:
AG002SZV
Chemical Name:
1H-Isoindole-5-carbonitrile, 2,3-dihydro-
CAS Number:
263888-58-0
Molecular Formula:
C9H8N2
Molecular Weight:
144.1732
MDL Number:
MFCD08234858
IUPAC Name:
2,3-dihydro-1H-isoindole-5-carbonitrile
InChI:
InChI=1S/C9H8N2/c10-4-7-1-2-8-5-11-6-9(8)3-7/h1-3,11H,5-6H2
InChI Key:
NHIKDNWKXUBYHV-UHFFFAOYSA-N
SMILES:
N#Cc1ccc2c(c1)CNC2
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.069g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
144.177g/mol
Monoisotopic Mass:
144.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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