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221292-48-4 | Benzene, 1,4-diiodo-2,5-dipropoxy-
CAS No: 221292-48-4 Catalog No: AG007PJ0 MDL No:
Product Description
Catalog Number:
AG007PJ0
Chemical Name:
Benzene, 1,4-diiodo-2,5-dipropoxy-
CAS Number:
221292-48-4
Molecular Formula:
C12H16I2O2
Molecular Weight:
446.0632
IUPAC Name:
1,4-diiodo-2,5-dipropoxybenzene
InChI:
InChI=1S/C12H16I2O2/c1-3-5-15-11-7-10(14)12(8-9(11)13)16-6-4-2/h7-8H,3-6H2,1-2H3
InChI Key:
XEIABPQMDIQKBB-UHFFFAOYSA-N
SMILES:
CCCOc1cc(I)c(cc1I)OCCC
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
445.924g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
446.067g/mol
Monoisotopic Mass:
445.924g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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