Home Halogens 3-Quinolinecarbonitrile, 4-chloro-6-iodo-

3-Quinolinecarbonitrile, 4-chloro-6-iodo-

CAS No.:
214483-20-2
Catalog Number:
AG00BIVH
Molecular Formula:
C10H4ClIN2
Molecular Weight:
314.5096
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Product Description
Catalog Number:
AG00BIVH
Chemical Name:
3-Quinolinecarbonitrile, 4-chloro-6-iodo-
CAS Number:
214483-20-2
Molecular Formula:
C10H4ClIN2
Molecular Weight:
314.5096
MDL Number:
MFCD11194094
IUPAC Name:
4-chloro-6-iodoquinoline-3-carbonitrile
InChI:
InChI=1S/C10H4ClIN2/c11-10-6(4-13)5-14-9-2-1-7(12)3-8(9)10/h1-3,5H
InChI Key:
XNFXSSJHMYBWJY-UHFFFAOYSA-N
SMILES:
N#Cc1cnc2c(c1Cl)cc(cc2)I
Properties
Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.911g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
314.51g/mol
Monoisotopic Mass:
313.911g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties