(2S)-2-amino-3-methyl-3-sulfinobutanoic acid


Chemical Name: (2S)-2-amino-3-methyl-3-sulfinobutanoic acid
CAS Number: 98462-04-5
Product Number: AG01FNS2(AGN-PC-0MYFK9)
Synonyms:
MDL No:
Molecular Formula: C5H11NO4S
Molecular Weight: 181.21014

Identification/Properties


Computed Properties
Molecular Weight:
181.206g/mol
XLogP3:
-3.6
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
3
Exact Mass:
181.041g/mol
Monoisotopic Mass:
181.041g/mol
Topological Polar Surface Area:
120A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
191
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

Safety Information


NMR Spectrum


Other Analytical Data


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