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205884-48-6

205884-48-6 | Benzene, 1-(hexyloxy)-2,5-diiodo-4-methoxy-

CAS No: 205884-48-6 Catalog No: AG002AEM MDL No:

Product Description

Catalog Number:
AG002AEM
Chemical Name:
Benzene, 1-(hexyloxy)-2,5-diiodo-4-methoxy-
CAS Number:
205884-48-6
Molecular Formula:
C13H18I2O2
Molecular Weight:
460.0898
IUPAC Name:
1-hexoxy-2,5-diiodo-4-methoxybenzene
InChI:
InChI=1S/C13H18I2O2/c1-3-4-5-6-7-17-13-9-10(14)12(16-2)8-11(13)15/h8-9H,3-7H2,1-2H3
InChI Key:
VKSUOELMGVTPEE-UHFFFAOYSA-N
SMILES:
CCCCCCOc1cc(I)c(cc1I)OC

Properties

Complexity:
202  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
459.94g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
460.094g/mol
Monoisotopic Mass:
459.94g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5  

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