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917483-55-7 | Thiophene, 2,2'-(1-methylethylidene)bis[5-[2-(4-iodophenyl)ethenyl]-
CAS No: 917483-55-7 Catalog No: AG006DQL MDL No:
Product Description
Catalog Number:
AG006DQL
Chemical Name:
Thiophene, 2,2'-(1-methylethylidene)bis[5-[2-(4-iodophenyl)ethenyl]-
CAS Number:
917483-55-7
Molecular Formula:
C27H22I2S2
Molecular Weight:
664.4025
IUPAC Name:
2-[2-(4-iodophenyl)ethenyl]-5-[2-[5-[2-(4-iodophenyl)ethenyl]thiophen-2-yl]propan-2-yl]thiophene
InChI:
InChI=1S/C27H22I2S2/c1-27(2,25-17-15-23(30-25)13-7-19-3-9-21(28)10-4-19)26-18-16-24(31-26)14-8-20-5-11-22(29)12-6-20/h3-18H,1-2H3
InChI Key:
DWHQCRLSCMQZHU-UHFFFAOYSA-N
SMILES:
CC(c1ccc(s1)C=Cc1ccc(cc1)I)(c1ccc(s1)C=Cc1ccc(cc1)I)C
Properties
Complexity:
563
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
663.925g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
664.402g/mol
Monoisotopic Mass:
663.925g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
10.1
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