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Home > Bromides > 1020718-01-7
1020718-01-7 | Benzene, 2-bromo-3,4,5-trifluoro-1-nitro-
CAS No: 1020718-01-7 Catalog No: AG0006J8 MDL No:MFCD09955450
Product Description
Catalog Number:
AG0006J8
Chemical Name:
Benzene, 2-bromo-3,4,5-trifluoro-1-nitro-
CAS Number:
1020718-01-7
Molecular Formula:
C6HBrF3NO2
Molecular Weight:
255.9768
MDL Number:
MFCD09955450
IUPAC Name:
4-bromo-1,2,3-trifluoro-5-nitrobenzene
InChI:
InChI=1S/C6HBrF3NO2/c7-4-3(11(12)13)1-2(8)5(9)6(4)10/h1H
InChI Key:
RISQAVRTASTTPY-UHFFFAOYSA-N
SMILES:
Fc1cc([N+](=O)[O-])c(c(c1F)F)Br
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.914g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.978g/mol
Monoisotopic Mass:
254.914g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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