Ethanol, 2-(2-hydroxyethoxy)-, 1-(4-methylbenzenesulfonate)


Chemical Name: Ethanol, 2-(2-hydroxyethoxy)-, 1-(4-methylbenzenesulfonate)
CAS Number: 118591-58-5
Product Number: AG0039EX(AGN-PC-0PC6JR)
Synonyms:
MDL No:
Molecular Formula: C11H16O5S
Molecular Weight: 260.3067

Identification/Properties


Computed Properties
Molecular Weight:
260.304g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
7
Exact Mass:
260.072g/mol
Monoisotopic Mass:
260.072g/mol
Topological Polar Surface Area:
81.2A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
288
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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