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845866-85-5 | 1-Bromo-3-fluoro-5-iodobenzene
CAS No: 845866-85-5 Catalog No: AG00364Q MDL No:MFCD06657969
Product Description
Catalog Number:
AG00364Q
Chemical Name:
1-Bromo-3-fluoro-5-iodobenzene
CAS Number:
845866-85-5
Molecular Formula:
C6H3BrFI
Molecular Weight:
300.8949
MDL Number:
MFCD06657969
IUPAC Name:
1-bromo-3-fluoro-5-iodobenzene
InChI:
InChI=1S/C6H3BrFI/c7-4-1-5(8)3-6(9)2-4/h1-3H
InChI Key:
OQUKJSVQMVBUBY-UHFFFAOYSA-N
SMILES:
Fc1cc(Br)cc(c1)I
Properties
Complexity:
99.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.845g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
300.897g/mol
Monoisotopic Mass:
299.845g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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