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Home > Bromides > 1807089-08-2
1807089-08-2 | Benzamide, 3-bromo-5-fluoro-4-nitro-
CAS No: 1807089-08-2 Catalog No: AG00228X MDL No:
Product Description
Catalog Number:
AG00228X
Chemical Name:
Benzamide, 3-bromo-5-fluoro-4-nitro-
CAS Number:
1807089-08-2
Molecular Formula:
C7H4BrFN2O3
Molecular Weight:
263.0207
IUPAC Name:
3-bromo-5-fluoro-4-nitrobenzamide
InChI:
InChI=1S/C7H4BrFN2O3/c8-4-1-3(7(10)12)2-5(9)6(4)11(13)14/h1-2H,(H2,10,12)
InChI Key:
QQICEQSHIXMSND-UHFFFAOYSA-N
SMILES:
NC(=O)c1cc(F)c(c(c1)Br)[N+](=O)[O-]
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.939g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
263.022g/mol
Monoisotopic Mass:
261.939g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
88.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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