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160976-02-3 | Benzene, 5-bromo-1,3-difluoro-2-iodo-
CAS No: 160976-02-3 Catalog No: AG001VKJ MDL No:MFCD01861126
Product Description
Catalog Number:
AG001VKJ
Chemical Name:
Benzene, 5-bromo-1,3-difluoro-2-iodo-
CAS Number:
160976-02-3
Molecular Formula:
C6H2BrF2I
Molecular Weight:
318.8854
MDL Number:
MFCD01861126
IUPAC Name:
5-bromo-1,3-difluoro-2-iodobenzene
InChI:
InChI=1S/C6H2BrF2I/c7-3-1-4(8)6(10)5(9)2-3/h1-2H
InChI Key:
NLWAKVGODLJALJ-UHFFFAOYSA-N
SMILES:
Brc1cc(F)c(c(c1)F)I
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.835g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.887g/mol
Monoisotopic Mass:
317.835g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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