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88388-95-8 | Benzene, 1,1'-[(dichloroethenylidene)bis(thio)]bis[4-methyl-
CAS No: 88388-95-8 Catalog No: AG004LJE MDL No:
Product Description
Catalog Number:
AG004LJE
Chemical Name:
Benzene, 1,1'-[(dichloroethenylidene)bis(thio)]bis[4-methyl-
CAS Number:
88388-95-8
Molecular Formula:
C16H14Cl2S2
Molecular Weight:
341.3184
IUPAC Name:
1-[2,2-dichloro-1-(4-methylphenyl)sulfanylethenyl]sulfanyl-4-methylbenzene
InChI:
InChI=1S/C16H14Cl2S2/c1-11-3-7-13(8-4-11)19-16(15(17)18)20-14-9-5-12(2)6-10-14/h3-10H,1-2H3
InChI Key:
KTYSEYUILQVVIM-UHFFFAOYSA-N
SMILES:
ClC(=C(Sc1ccc(cc1)C)Sc1ccc(cc1)C)Cl
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.991g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
341.308g/mol
Monoisotopic Mass:
339.991g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7
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