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Home > Bromides > 1394291-47-4
1394291-47-4 | Benzene, 5-bromo-1-fluoro-2-iodo-3-methoxy-
CAS No: 1394291-47-4 Catalog No: AG001B0G MDL No:MFCD22543687
Product Description
Catalog Number:
AG001B0G
Chemical Name:
Benzene, 5-bromo-1-fluoro-2-iodo-3-methoxy-
CAS Number:
1394291-47-4
Molecular Formula:
C7H5BrFIO
Molecular Weight:
330.9209
MDL Number:
MFCD22543687
IUPAC Name:
5-bromo-1-fluoro-2-iodo-3-methoxybenzene
InChI:
InChI=1S/C7H5BrFIO/c1-11-6-3-4(8)2-5(9)7(6)10/h2-3H,1H3
InChI Key:
OCZGPFJUJPKXEC-UHFFFAOYSA-N
SMILES:
COc1cc(Br)cc(c1I)F
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.855g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.923g/mol
Monoisotopic Mass:
329.855g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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