2-propan-2-ylsulfonylaniline


Chemical Name: 2-propan-2-ylsulfonylaniline
CAS Number: 76697-50-2
Product Number: AG003DXG(AGN-PC-0NJQSV)
Synonyms:
MDL No: MFCD08445603
Molecular Formula: C9H13NO2S
Molecular Weight: 199.2700

Identification/Properties


Properties
MP:
83.0 to 87.0 °C
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
199.268g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
199.067g/mol
Monoisotopic Mass:
199.067g/mol
Topological Polar Surface Area:
68.5A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
253
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


NMR Spectrum


Other Analytical Data


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