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442910-33-0 | 2-Fluoro-5-iodobenzyl bromide
CAS No: 442910-33-0 Catalog No: AG01EVZ2 MDL No:
Product Description
Catalog Number:
AG01EVZ2
Chemical Name:
2-Fluoro-5-iodobenzyl bromide
CAS Number:
442910-33-0
Molecular Formula:
C7H5BrFI
Molecular Weight:
314.9215
IUPAC Name:
2-(bromomethyl)-1-fluoro-4-iodobenzene
InChI:
InChI=1S/C7H5BrFI/c8-4-5-3-6(10)1-2-7(5)9/h1-3H,4H2
InChI Key:
YSSWCSYAQLKZNM-UHFFFAOYSA-N
SMILES:
BrCc1cc(I)ccc1F
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.86g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
314.924g/mol
Monoisotopic Mass:
313.86g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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