Home Sulfos Benzenamine, 4-methyl-3-(methylsulfonyl)-

Benzenamine, 4-methyl-3-(methylsulfonyl)-

CAS No.:
307989-41-9
Catalog Number:
AG0031B0
Molecular Formula:
C8H11NO2S
Molecular Weight:
185.2434
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Product Description
Catalog Number:
AG0031B0
Chemical Name:
Benzenamine, 4-methyl-3-(methylsulfonyl)-
CAS Number:
307989-41-9
Molecular Formula:
C8H11NO2S
Molecular Weight:
185.2434
MDL Number:
MFCD16809481
IUPAC Name:
4-methyl-3-methylsulfonylaniline
InChI:
InChI=1S/C8H11NO2S/c1-6-3-4-7(9)5-8(6)12(2,10)11/h3-5H,9H2,1-2H3
InChI Key:
KGJPTUKXABCZOR-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)S(=O)(=O)C)C
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:
0.8  
Properties