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855836-52-1 | 3-Bromo-2-iodophenol
CAS No: 855836-52-1 Catalog No: AG004QI4 MDL No:MFCD08166320
Product Description
Catalog Number:
AG004QI4
Chemical Name:
3-Bromo-2-iodophenol
CAS Number:
855836-52-1
Molecular Formula:
C6H4BrIO
Molecular Weight:
298.9038
MDL Number:
MFCD08166320
IUPAC Name:
3-bromo-2-iodophenol
InChI:
InChI=1S/C6H4BrIO/c7-4-2-1-3-5(9)6(4)8/h1-3,9H
InChI Key:
WJJYPSTVJBRTGK-UHFFFAOYSA-N
SMILES:
Ic1c(O)cccc1Br
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:
297.849g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
298.905g/mol
Monoisotopic Mass:
297.849g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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