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102454-61-5 | Benzene, 1,1'-[1,4-butanediylbis(oxy)]bis[4-(ethylthio)- (9CI)
CAS No: 102454-61-5 Catalog No: AG0007II MDL No:
Product Description
Catalog Number:
AG0007II
Chemical Name:
Benzene, 1,1'-[1,4-butanediylbis(oxy)]bis[4-(ethylthio)- (9CI)
CAS Number:
102454-61-5
Molecular Formula:
C20H26O2S2
Molecular Weight:
362.5492
IUPAC Name:
1-ethylsulfanyl-4-[4-(4-ethylsulfanylphenoxy)butoxy]benzene
InChI:
InChI=1S/C20H26O2S2/c1-3-23-19-11-7-17(8-12-19)21-15-5-6-16-22-18-9-13-20(14-10-18)24-4-2/h7-14H,3-6,15-16H2,1-2H3
InChI Key:
UJLWFUQCBDQWEO-UHFFFAOYSA-N
SMILES:
CCSc1ccc(cc1)OCCCCOc1ccc(cc1)SCC
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
362.137g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
362.546g/mol
Monoisotopic Mass:
362.137g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
69.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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