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113495-49-1 | Isoindolo[1,2-a]isoquinoline-8-carbonitrile
CAS No: 113495-49-1 Catalog No: AG0008RI MDL No:
Product Description
Catalog Number:
AG0008RI
Chemical Name:
Isoindolo[1,2-a]isoquinoline-8-carbonitrile
CAS Number:
113495-49-1
Molecular Formula:
C17H10N2
Molecular Weight:
242.2747
IUPAC Name:
isoindolo[1,2-a]isoquinoline-8-carbonitrile
InChI:
InChI=1S/C17H10N2/c18-11-16-14-7-3-4-8-15(14)17-13-6-2-1-5-12(13)9-10-19(16)17/h1-10H
InChI Key:
PFAHVNXKTLJPJG-UHFFFAOYSA-N
SMILES:
N#Cc1n2ccc3c(c2c2c1cccc2)cccc3
Properties
Complexity:
395
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.084g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.281g/mol
Monoisotopic Mass:
242.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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