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78812-64-3 | Ethanone,2-hydroxy-1-(4-iodophenyl)-
CAS No: 78812-64-3 Catalog No: AG005DFX MDL No:MFCD09998234
Product Description
Catalog Number:
AG005DFX
Chemical Name:
Ethanone,2-hydroxy-1-(4-iodophenyl)-
CAS Number:
78812-64-3
Molecular Formula:
C8H7IO2
Molecular Weight:
262.0445
MDL Number:
MFCD09998234
IUPAC Name:
2-hydroxy-1-(4-iodophenyl)ethanone
InChI:
InChI=1S/C8H7IO2/c9-7-3-1-6(2-4-7)8(11)5-10/h1-4,10H,5H2
InChI Key:
LRMMTBOVAYKZAH-UHFFFAOYSA-N
SMILES:
OCC(=O)c1ccc(cc1)I
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.949g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
262.046g/mol
Monoisotopic Mass:
261.949g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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