Home Sulfos 4-methanesulfonyl-N-(propan-2-yl)aniline

4-methanesulfonyl-N-(propan-2-yl)aniline

CAS No.:
1021125-82-5
Catalog Number:
AG01A8OI
Molecular Formula:
C10H15NO2S
Molecular Weight:
213.2966
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Product Description
Catalog Number:
AG01A8OI
Chemical Name:
4-methanesulfonyl-N-(propan-2-yl)aniline
CAS Number:
1021125-82-5
Molecular Formula:
C10H15NO2S
Molecular Weight:
213.2966
MDL Number:
MFCD11143921
IUPAC Name:
4-methylsulfonyl-N-propan-2-ylaniline
InChI:
InChI=1S/C10H15NO2S/c1-8(2)11-9-4-6-10(7-5-9)14(3,12)13/h4-8,11H,1-3H3
InChI Key:
KLWXJIXQZNBHRZ-UHFFFAOYSA-N
SMILES:
CC(Nc1ccc(cc1)S(=O)(=O)C)C
Properties
Complexity:
258  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.082g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.295g/mol
Monoisotopic Mass:
213.082g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties