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143994-82-5 | 2,5,8-Trioxa-12-thiatridecane, 10-[2-(2-methoxyethoxy)ethoxy]-13-phenyl-
CAS No: 143994-82-5 Catalog No: AG001IQT MDL No:
Product Description
Catalog Number:
AG001IQT
Chemical Name:
2,5,8-Trioxa-12-thiatridecane, 10-[2-(2-methoxyethoxy)ethoxy]-13-phenyl-
CAS Number:
143994-82-5
Molecular Formula:
C20H34O6S
Molecular Weight:
402.5454
IUPAC Name:
2,3-bis[2-(2-methoxyethoxy)ethoxy]propylsulfanylmethylbenzene
InChI:
InChI=1S/C20H34O6S/c1-21-8-10-23-12-13-25-16-20(26-15-14-24-11-9-22-2)18-27-17-19-6-4-3-5-7-19/h3-7,20H,8-18H2,1-2H3
InChI Key:
SPWKKIZDGQVIIT-UHFFFAOYSA-N
SMILES:
COCCOCCOCC(CSCc1ccccc1)OCCOCCOC
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
402.208g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
402.546g/mol
Monoisotopic Mass:
402.208g/mol
Rotatable Bond Count:
19
Topological Polar Surface Area:
80.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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