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132586-14-2 | 5-Quinolinecarbonitrile, 4-chloro-
CAS No: 132586-14-2 Catalog No: AG0010VG MDL No:MFCD08688611
Product Description
Catalog Number:
AG0010VG
Chemical Name:
5-Quinolinecarbonitrile, 4-chloro-
CAS Number:
132586-14-2
Molecular Formula:
C10H5ClN2
Molecular Weight:
188.6131
MDL Number:
MFCD08688611
IUPAC Name:
4-chloroquinoline-5-carbonitrile
InChI:
InChI=1S/C10H5ClN2/c11-8-4-5-13-9-3-1-2-7(6-12)10(8)9/h1-5H
InChI Key:
CZFLCFMMESPBGQ-UHFFFAOYSA-N
SMILES:
N#Cc1cccc2c1c(Cl)ccn2
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.014g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.614g/mol
Monoisotopic Mass:
188.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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