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205490-77-3 | 1-Hexanethiol, 6-(1,4,7,10,13-pentaoxacyclopentadec-2-ylmethoxy)-
CAS No: 205490-77-3 Catalog No: AG002A4H MDL No:
Product Description
Catalog Number:
AG002A4H
Chemical Name:
1-Hexanethiol, 6-(1,4,7,10,13-pentaoxacyclopentadec-2-ylmethoxy)-
CAS Number:
205490-77-3
Molecular Formula:
C17H34O6S
Molecular Weight:
366.5133
IUPAC Name:
6-(1,4,7,10,13-pentaoxacyclopentadec-2-ylmethoxy)hexane-1-thiol
InChI:
InChI=1S/C17H34O6S/c24-14-4-2-1-3-5-21-15-17-16-22-11-10-19-7-6-18-8-9-20-12-13-23-17/h17,24H,1-16H2
InChI Key:
GBVVTFHPCIGWAK-UHFFFAOYSA-N
SMILES:
SCCCCCCOCC1COCCOCCOCCOCCO1
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
366.208g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
366.513g/mol
Monoisotopic Mass:
366.208g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
56.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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