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67185-80-2 | Phenol, 4,4'-(1-methylethylidene)bis[2-iodo-
CAS No: 67185-80-2 Catalog No: AG005QH5 MDL No:
Product Description
Catalog Number:
AG005QH5
Chemical Name:
Phenol, 4,4'-(1-methylethylidene)bis[2-iodo-
CAS Number:
67185-80-2
Molecular Formula:
C15H14I2O2
Molecular Weight:
480.0794
IUPAC Name:
4-[2-(4-hydroxy-3-iodophenyl)propan-2-yl]-2-iodophenol
InChI:
InChI=1S/C15H14I2O2/c1-15(2,9-3-5-13(18)11(16)7-9)10-4-6-14(19)12(17)8-10/h3-8,18-19H,1-2H3
InChI Key:
VOZDENSTGQZUID-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1I)C(c1ccc(c(c1)I)O)(C)C
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
479.908g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
480.084g/mol
Monoisotopic Mass:
479.908g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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