Glycine, N-[2-(methylthio)-1-oxopropyl]-


Chemical Name: Glycine, N-[2-(methylthio)-1-oxopropyl]-
CAS Number: 87254-91-9
Product Number: AG008ETV(AGN-PC-05XF6J)
Synonyms:
MDL No:
Molecular Formula: C6H11NO3S
Molecular Weight: 177.2214

Identification/Properties


Computed Properties
Molecular Weight:
177.218g/mol
XLogP3:
0.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
177.046g/mol
Monoisotopic Mass:
177.046g/mol
Topological Polar Surface Area:
91.7A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
160
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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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