Butanoic acid, 2-amino-4-(methylsulfinyl)-, (2S)-


Chemical Name: Butanoic acid, 2-amino-4-(methylsulfinyl)-, (2S)-
CAS Number: 3226-65-1
Product Number: AG00I649(AGN-PC-0O8WLK)
Synonyms:
MDL No:
Molecular Formula: C5H11NO3S
Molecular Weight: 165.2107

Identification/Properties


Properties
MP:
234-235°C
BP:
434.3°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
165.207g/mol
XLogP3:
-4.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
165.046g/mol
Monoisotopic Mass:
165.046g/mol
Topological Polar Surface Area:
99.6A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
148
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
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


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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