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851345-56-7

851345-56-7 | Benzene, 1,4-diiodo-2,5-bis[(1E)-2-[4-(1-methylethyl)phenyl]ethenyl]-

CAS No: 851345-56-7 Catalog No: AG004O3P MDL No:

Product Description

Catalog Number:
AG004O3P
Chemical Name:
Benzene, 1,4-diiodo-2,5-bis[(1E)-2-[4-(1-methylethyl)phenyl]ethenyl]-
CAS Number:
851345-56-7
Molecular Formula:
C28H28I2
Molecular Weight:
618.3309
IUPAC Name:
1,4-diiodo-2,5-bis[2-(4-propan-2-ylphenyl)ethenyl]benzene
InChI:
InChI=1S/C28H28I2/c1-19(2)23-11-5-21(6-12-23)9-15-25-17-28(30)26(18-27(25)29)16-10-22-7-13-24(14-8-22)20(3)4/h5-20H,1-4H3
InChI Key:
PHRSYSLBRZZMIQ-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)/C=C/c1cc(I)c(cc1I)/C=C/c1ccc(cc1)C(C)C)C

Properties

Complexity:
497  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
618.028g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
618.341g/mol
Monoisotopic Mass:
618.028g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2  
XLogP3:
10  

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