Home Sulfos 4-methyl-2-(methylsulfonyl)aniline

4-methyl-2-(methylsulfonyl)aniline

CAS No.:
4284-63-3
Catalog Number:
AG018SGF
Molecular Formula:
C8H11NO2S
Molecular Weight:
185.2434
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Product Description
Catalog Number:
AG018SGF
Chemical Name:
4-methyl-2-(methylsulfonyl)aniline
CAS Number:
4284-63-3
Molecular Formula:
C8H11NO2S
Molecular Weight:
185.2434
MDL Number:
MFCD20699519
IUPAC Name:
4-methyl-2-methylsulfonylaniline
InChI:
InChI=1S/C8H11NO2S/c1-6-3-4-7(9)8(5-6)12(2,10)11/h3-5H,9H2,1-2H3
InChI Key:
KYZYZYOWGLRKLJ-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)S(=O)(=O)C)N
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.051g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
185.241g/mol
Monoisotopic Mass:
185.051g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties