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Home > Bromides > 2091656-96-9
2091656-96-9 | 4-Bromo-3-fluoro-2-iodoaniline
CAS No: 2091656-96-9 Catalog No: AG01FF3F MDL No:
Product Description
Catalog Number:
AG01FF3F
Chemical Name:
4-Bromo-3-fluoro-2-iodoaniline
CAS Number:
2091656-96-9
Molecular Formula:
C6H4BrFIN
Molecular Weight:
315.9095
IUPAC Name:
4-bromo-3-fluoro-2-iodoaniline
InChI:
InChI=1S/C6H4BrFIN/c7-3-1-2-4(10)6(9)5(3)8/h1-2H,10H2
InChI Key:
WFNGHQDVQUWGEX-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1F)I)N
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.856g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
315.912g/mol
Monoisotopic Mass:
314.856g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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