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Home > Bromides > 1393585-66-4
1393585-66-4 | Benzonitrile, 2,4-dibromo-6-fluoro-
CAS No: 1393585-66-4 Catalog No: AG001AU0 MDL No:MFCD22377850
Product Description
Catalog Number:
AG001AU0
Chemical Name:
Benzonitrile, 2,4-dibromo-6-fluoro-
CAS Number:
1393585-66-4
Molecular Formula:
C7H2Br2FN
Molecular Weight:
278.9039
MDL Number:
MFCD22377850
IUPAC Name:
2,4-dibromo-6-fluorobenzonitrile
InChI:
InChI=1S/C7H2Br2FN/c8-4-1-6(9)5(3-11)7(10)2-4/h1-2H
InChI Key:
VEJXWWDHQYGSQN-UHFFFAOYSA-N
SMILES:
N#Cc1c(F)cc(cc1Br)Br
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.852g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.906g/mol
Monoisotopic Mass:
276.854g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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