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446-09-3 | 2-Bromo-5-fluoronitrobenzene
CAS No: 446-09-3 Catalog No: AG003GPR MDL No:MFCD00055530
Product Description
Catalog Number:
AG003GPR
Chemical Name:
2-Bromo-5-fluoronitrobenzene
CAS Number:
446-09-3
Molecular Formula:
C6H3BrFNO2
Molecular Weight:
219.9959
MDL Number:
MFCD00055530
IUPAC Name:
1-bromo-4-fluoro-2-nitrobenzene
InChI:
InChI=1S/C6H3BrFNO2/c7-5-2-1-4(8)3-6(5)9(10)11/h1-3H
InChI Key:
XRXNWKIKQFEOGO-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)[N+](=O)[O-])Br
EC Number:
207-160-2
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.933g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.997g/mol
Monoisotopic Mass:
218.933g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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