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Home > Bromides > 1806987-57-4
1806987-57-4 | Phenol, 2-bromo-3-fluoro-4-nitro-
CAS No: 1806987-57-4 Catalog No: AG002287 MDL No:MFCD26407438
Product Description
Catalog Number:
AG002287
Chemical Name:
Phenol, 2-bromo-3-fluoro-4-nitro-
CAS Number:
1806987-57-4
Molecular Formula:
C6H3BrFNO3
Molecular Weight:
235.9953
MDL Number:
MFCD26407438
IUPAC Name:
2-bromo-3-fluoro-4-nitrophenol
InChI:
InChI=1S/C6H3BrFNO3/c7-5-4(10)2-1-3(6(5)8)9(11)12/h1-2,10H
InChI Key:
MENHOWWFFRZGPA-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(c(c1F)Br)O
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.928g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
235.996g/mol
Monoisotopic Mass:
234.928g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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