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113487-07-3 | Ethanol, 2-[2-[[2-(2-hydroxyethoxy)decyl]thio]ethoxy]-
CAS No: 113487-07-3 Catalog No: AG0008R3 MDL No:
Product Description
Catalog Number:
AG0008R3
Chemical Name:
Ethanol, 2-[2-[[2-(2-hydroxyethoxy)decyl]thio]ethoxy]-
CAS Number:
113487-07-3
Molecular Formula:
C16H34O4S
Molecular Weight:
322.5038
IUPAC Name:
2-[2-[2-(2-hydroxyethoxy)decylsulfanyl]ethoxy]ethanol
InChI:
InChI=1S/C16H34O4S/c1-2-3-4-5-6-7-8-16(20-12-10-18)15-21-14-13-19-11-9-17/h16-18H,2-15H2,1H3
InChI Key:
COCKOFKZVDEFGM-UHFFFAOYSA-N
SMILES:
OCCOC(CSCCOCCO)CCCCCCCC
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.218g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
322.504g/mol
Monoisotopic Mass:
322.218g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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