Home Sulfos 4-(ethanesulfonyl)aniline hydrochloride

4-(ethanesulfonyl)aniline hydrochloride

CAS No.:
879685-29-7
Catalog Number:
AG019M57
Molecular Formula:
C8H12ClNO2S
Molecular Weight:
221.7044
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Product Description
Catalog Number:
AG019M57
Chemical Name:
4-(ethanesulfonyl)aniline hydrochloride
CAS Number:
879685-29-7
Molecular Formula:
C8H12ClNO2S
Molecular Weight:
221.7044
MDL Number:
MFCD09040951
IUPAC Name:
4-ethylsulfonylaniline;hydrochloride
InChI:
InChI=1S/C8H11NO2S.ClH/c1-2-12(10,11)8-5-3-7(9)4-6-8;/h3-6H,2,9H2,1H3;1H
InChI Key:
WTYYAXAHNXLQSW-UHFFFAOYSA-N
SMILES:
CCS(=O)(=O)c1ccc(cc1)N.Cl
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.028g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
221.699g/mol
Monoisotopic Mass:
221.028g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties