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28896-49-3 | Benzene, 1,1'-oxybis[4-iodo-
CAS No: 28896-49-3 Catalog No: AG002WYU MDL No:
Product Description
Catalog Number:
AG002WYU
Chemical Name:
Benzene, 1,1'-oxybis[4-iodo-
CAS Number:
28896-49-3
Molecular Formula:
C12H8I2O
Molecular Weight:
422.0003
IUPAC Name:
1-iodo-4-(4-iodophenoxy)benzene
InChI:
InChI=1S/C12H8I2O/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8H
InChI Key:
VHEGXFQQYZIMMF-UHFFFAOYSA-N
SMILES:
Ic1ccc(cc1)Oc1ccc(cc1)I
NSC Number:
45097
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
421.866g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
422.004g/mol
Monoisotopic Mass:
421.866g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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