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173428-79-0 | Benzene, 1,4-bis[(2-ethylhexyl)oxy]-2,5-diiodo-
CAS No: 173428-79-0 Catalog No: AG001YVQ MDL No:
Product Description
Catalog Number:
AG001YVQ
Chemical Name:
Benzene, 1,4-bis[(2-ethylhexyl)oxy]-2,5-diiodo-
CAS Number:
173428-79-0
Molecular Formula:
C22H36I2O2
Molecular Weight:
586.3290
IUPAC Name:
1,4-bis(2-ethylhexoxy)-2,5-diiodobenzene
InChI:
InChI=1S/C22H36I2O2/c1-5-9-11-17(7-3)15-25-21-13-20(24)22(14-19(21)23)26-16-18(8-4)12-10-6-2/h13-14,17-18H,5-12,15-16H2,1-4H3
InChI Key:
AQMYDNZYNAHZIH-UHFFFAOYSA-N
SMILES:
CCCCC(COc1cc(I)c(cc1I)OCC(CCCC)CC)CC
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
586.08g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
586.337g/mol
Monoisotopic Mass:
586.08g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
9.4
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