Benzeneacetic acid, 3-[(methylsulfonyl)amino]-


Chemical Name: Benzeneacetic acid, 3-[(methylsulfonyl)amino]-
CAS Number: 407640-21-5
Product Number: AG003I96(AGN-PC-0KKVRD)
Synonyms:
MDL No: MFCD03411194
Molecular Formula: C9H11NO4S
Molecular Weight: 229.2529

Identification/Properties


Properties
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
229.25g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
229.041g/mol
Monoisotopic Mass:
229.041g/mol
Topological Polar Surface Area:
91.8A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
320
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

Safety Information


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

NMR Spectrum


Other Analytical Data


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