ISOOCTYL THIOGLYCOLATE


Chemical Name: ISOOCTYL THIOGLYCOLATE
CAS Number: 25103-09-7
Product Number: AG003R43(AGN-PC-0WAFXD)
Synonyms:
MDL No:
Molecular Formula: C10H20O2S
Molecular Weight: 204.3296

Identification/Properties


Computed Properties
Molecular Weight:
204.328g/mol
XLogP3:
3.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
8
Exact Mass:
204.118g/mol
Monoisotopic Mass:
204.118g/mol
Topological Polar Surface Area:
27.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
135
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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