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71702-01-7

71702-01-7 | 5-BROMO-6-CHLORONICOTINONITRILE

CAS No: 71702-01-7 Catalog No: AG00365Q MDL No:MFCD11840998

Product Description

Catalog Number:
AG00365Q
Chemical Name:
5-BROMO-6-CHLORONICOTINONITRILE
CAS Number:
71702-01-7
Molecular Formula:
C6H2BrClN2
Molecular Weight:
217.4505
MDL Number:
MFCD11840998
IUPAC Name:
5-bromo-6-chloropyridine-3-carbonitrile
InChI:
InChI=1S/C6H2BrClN2/c7-5-1-4(2-9)3-10-6(5)8/h1,3H
InChI Key:
CYXYTFFWGHLPJE-UHFFFAOYSA-N
SMILES:
N#Cc1cnc(c(c1)Br)Cl

Properties

Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.909g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.45g/mol
Monoisotopic Mass:
215.909g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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