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1160574-31-1

1160574-31-1 | 3-Chloro-2,5-dibromobenzonitrile

CAS No: 1160574-31-1 Catalog No: AG01FEJW MDL No:MFCD11846068

Product Description

Catalog Number:
AG01FEJW
Chemical Name:
3-Chloro-2,5-dibromobenzonitrile
CAS Number:
1160574-31-1
Molecular Formula:
C7H2Br2ClN
Molecular Weight:
295.3585
MDL Number:
MFCD11846068
IUPAC Name:
2,5-dibromo-3-chlorobenzonitrile
InChI:
InChI=1S/C7H2Br2ClN/c8-5-1-4(3-11)7(9)6(10)2-5/h1-2H
InChI Key:
XCRQAJPVMUVALD-UHFFFAOYSA-N
SMILES:
N#Cc1cc(Br)cc(c1Br)Cl

Properties

Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.822g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.358g/mol
Monoisotopic Mass:
292.824g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  

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