Home Sulfos 3-(cyclohexanesulfonyl)aniline

3-(cyclohexanesulfonyl)aniline

CAS No.:
80213-38-3
Catalog Number:
AG01AM18
Molecular Formula:
C12H17NO2S
Molecular Weight:
239.3339
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Product Description
Catalog Number:
AG01AM18
Chemical Name:
3-(cyclohexanesulfonyl)aniline
CAS Number:
80213-38-3
Molecular Formula:
C12H17NO2S
Molecular Weight:
239.3339
MDL Number:
MFCD24062676
IUPAC Name:
3-cyclohexylsulfonylaniline
InChI:
InChI=1S/C12H17NO2S/c13-10-5-4-8-12(9-10)16(14,15)11-6-2-1-3-7-11/h4-5,8-9,11H,1-3,6-7,13H2
InChI Key:
MADJWEUNBYTMSF-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)S(=O)(=O)C1CCCCC1
Properties
Complexity:
314  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.098g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
239.333g/mol
Monoisotopic Mass:
239.098g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties