Home Nitriles 4-Chloroquinoline-6-carbonitrile

4-Chloroquinoline-6-carbonitrile

CAS No.:
219763-83-4
Catalog Number:
AG007OJO
Molecular Formula:
C10H5ClN2
Molecular Weight:
188.6131
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Product Description
Catalog Number:
AG007OJO
Chemical Name:
4-Chloroquinoline-6-carbonitrile
CAS Number:
219763-83-4
Molecular Formula:
C10H5ClN2
Molecular Weight:
188.6131
MDL Number:
MFCD08063204
IUPAC Name:
4-chloroquinoline-6-carbonitrile
InChI:
InChI=1S/C10H5ClN2/c11-9-3-4-13-10-2-1-7(6-12)5-8(9)10/h1-5H
InChI Key:
FLRGXIDFVYOCLP-UHFFFAOYSA-N
SMILES:
N#Cc1ccc2c(c1)c(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  
Properties