(2S)-2-[(3-chloro-4-fluorophenyl)sulfonylamino]-4-methylsulfanylbutanoic acid


Chemical Name: (2S)-2-[(3-chloro-4-fluorophenyl)sulfonylamino]-4-methylsulfanylbutanoic acid
CAS Number: 1009235-46-4
Product Number: AG0197ZF(AGN-PC-0K6YR0)
Synonyms:
MDL No: MFCD03619000
Molecular Formula: C11H13ClFNO4S2
Molecular Weight: 341.8066

Identification/Properties


Computed Properties
Molecular Weight:
341.796g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
7
Exact Mass:
340.996g/mol
Monoisotopic Mass:
340.996g/mol
Topological Polar Surface Area:
117A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
429
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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