Home Sulfos 3-chloro-2-(propane-2-sulfonyl)aniline

3-chloro-2-(propane-2-sulfonyl)aniline

CAS No.:
1097921-24-8
Catalog Number:
AG01B9JI
Molecular Formula:
C9H12ClNO2S
Molecular Weight:
233.7151
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Product Description
Catalog Number:
AG01B9JI
Chemical Name:
3-chloro-2-(propane-2-sulfonyl)aniline
CAS Number:
1097921-24-8
Molecular Formula:
C9H12ClNO2S
Molecular Weight:
233.7151
MDL Number:
MFCD24063274
IUPAC Name:
3-chloro-2-propan-2-ylsulfonylaniline
InChI:
InChI=1S/C9H12ClNO2S/c1-6(2)14(12,13)9-7(10)4-3-5-8(9)11/h3-6H,11H2,1-2H3
InChI Key:
VITISNUAFCEGKL-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1S(=O)(=O)C(C)C)Cl
Properties
Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.028g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.71g/mol
Monoisotopic Mass:
233.028g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties