b-D-Glucopyranoside, 2-mercaptoethyl


Chemical Name: b-D-Glucopyranoside, 2-mercaptoethyl
CAS Number: 130263-77-3
Product Number: AG0071BB(AGN-PC-0PJ6RR)
Synonyms:
MDL No:
Molecular Formula: C8H16O6S
Molecular Weight: 240.2740

Identification/Properties


Computed Properties
Molecular Weight:
240.27g/mol
XLogP3:
-1.9
Hydrogen Bond Donor Count:
5
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
4
Exact Mass:
240.067g/mol
Monoisotopic Mass:
240.067g/mol
Topological Polar Surface Area:
100A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
192
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
3
Undefined Atom Stereocenter Count:
2
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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