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207115-22-8 | Phenol, 4-bromo-2-iodo-
CAS No: 207115-22-8 Catalog No: AG002IU6 MDL No:MFCD09029644
Product Description
Catalog Number:
AG002IU6
Chemical Name:
Phenol, 4-bromo-2-iodo-
CAS Number:
207115-22-8
Molecular Formula:
C6H4BrIO
Molecular Weight:
298.9038
MDL Number:
MFCD09029644
IUPAC Name:
4-bromo-2-iodophenol
InChI:
InChI=1S/C6H4BrIO/c7-4-1-2-6(9)5(8)3-4/h1-3,9H
InChI Key:
UXIULWIJWDJDQD-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)I)O
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:
2.7
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