4-(methylsulfonyl)benzenamine
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Product Description
Product
4-(methylsulfonyl)benzenamine
CAS
5470-49-5
Formula
C7H9NO2S;
Synonym
4-(Methylsulfonyl)aniline; 4-(METHYLSULPHONYL)ANILINE; 4-mesylaniline; 4-Methylsulfonylaniline; 4-METHYLSULFONYL-BENZENEAMINE; AI3-08088; Aniline, p-(methylsulfonyl)-; Benzenamine, 4-(methylsulfonyl)-; BENZENEAMINE, 4-METHYLSULFONYL-; EINECS 226-803-8; niline, p-(methylsulfonyl)-;
; -(Methylsulfonyl)aniline
Typical Product Specifications
Molecular weight
171.22
EINECS
226-803-8
SMILES
Nc1ccc(S(=O)(=O)C)cc1
InChI
1S/C7H9NO2S/c1-11(9,10)7-4-2-6(8)3-5-7/h2-5H,8H2,1H3
InChIKey
XJEVFFNOMKXBLU-UHFFFAOYSA-N
Atmospheric OH Rate Constant
2.41E-11 cm3/molecule-sec
pKa Dissociation Constant
1.35
log P (octanol-water)
-0.12
Vapor Pressure
1.25E-04 mm Hg
Henry's Law Constant
4.41E-10 atm-m3/mole
Water solubility
7.68E+04 mg/L
Melting Point
243-245°C
Class
4-(methylsulfonyl)benzenamine
Product Description
Product
4-(methylsulfonyl)benzenamine
CAS
5470-49-5
Formula
C7H9NO2S;
Synonym
4-(Methylsulfonyl)aniline; 4-(METHYLSULPHONYL)ANILINE; 4-mesylaniline; 4-Methylsulfonylaniline; 4-METHYLSULFONYL-BENZENEAMINE; AI3-08088; Aniline, p-(methylsulfonyl)-; Benzenamine, 4-(methylsulfonyl)-; BENZENEAMINE, 4-METHYLSULFONYL-; EINECS 226-803-8; niline, p-(methylsulfonyl)-;
; -(Methylsulfonyl)aniline
Typical Product Specifications
Molecular weight
171.22
EINECS
226-803-8
SMILES
Nc1ccc(S(=O)(=O)C)cc1
InChI
1S/C7H9NO2S/c1-11(9,10)7-4-2-6(8)3-5-7/h2-5H,8H2,1H3
InChIKey
XJEVFFNOMKXBLU-UHFFFAOYSA-N
Atmospheric OH Rate Constant
2.41E-11 cm3/molecule-sec
pKa Dissociation Constant
1.35
log P (octanol-water)
-0.12
Vapor Pressure
1.25E-04 mm Hg
Henry's Law Constant
4.41E-10 atm-m3/mole
Water solubility
7.68E+04 mg/L
Melting Point
243-245°C
Class
