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4-Amino-N-methylbenzenemethanesulfonamide

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Name

4-Amino-N-methylbenzenemethanesulfonamide

EINECS -0
CAS No. 109903-35-7 Density 1.297 g/cm3
PSA 80.57000 LogP 2.37090
Solubility N/A Melting Point 140-142 °C(lit.)
Formula C8H12N2O2S Boiling Point 387.6 °C at 760 mmHg
Molecular Weight 200.261 Flash Point 188.2 °C
Transport Information UN 2811 6.1/PG 3 Appearance N/A
Safety 36/37 Risk Codes 22-43
Molecular Structure Molecular Structure of 109903-35-7 (4-Amino-N-methylbenzenemethanesulfonamide) Hazard Symbols HarmfulXn, IrritantXi
Synonyms

4-(((Methylamino)sulfonyl)methyl)aniline;1-(4-Aminophenyl)-N-methylmethanesulfonamide;

Article Data 4

4-Amino-N-methylbenzenemethanesulfonamide Specification

The 4-Amino-N-methyl-alpha-toluenesulfonamide, with the CAS registry number 109903-35-7, is also known as Benzenemethanesulfonamide, 4-amino-N-methyl-. It belongs to the product category of Benzene Derivates. This chemical's molecular formula is C8H12N2O2S and molecular weight is 200.26. Its systematic name is called 1-(4-aminophenyl)-N-methylmethanesulfonamide. The product should be sealed and stored in cool and dry place. What's more, it should be protected from strong oxides.

Physical properties of 4-Amino-N-methyl-alpha-toluenesulfonamide: (1)ACD/LogP: -0.46; (2)ACD/LogD (pH 5.5): -0.48; (3)ACD/LogD (pH 7.4): -0.46; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 12.86; (7)ACD/KOC (pH 7.4): 13.43; (8)#H bond acceptors: 4; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 3; (11)Index of Refraction: 1.589; (12)Molar Refractivity: 52.09 cm3; (13)Molar Volume: 154.3 cm3; (14)Surface Tension: 55.2 dyne/cm; (15)Density: 1.297 g/cm3; (16)Flash Point: 188.2 °C; (17)Enthalpy of Vaporization: 63.67 kJ/mol; (18)Boiling Point: 387.6 °C at 760 mmHg; (19)Vapour Pressure: 3.25E-06 mmHg at 25°C.

Uses of 4-Amino-N-methyl-alpha-toluenesulfonamide: it can be used to produce C-(4-amino-3-bromo-phenyl)-N-methyl-methanesulfonamide. This reaction will need reagent Br2 and solvent methanol. The yield is about 33%.

4-Amino-N-methyl-alpha-toluenesulfonamide can be used to produce C-(4-amino-3-bromo-phenyl)-N-methyl-methanesulfonamide

When you are using this chemical, please be cautious about it as the following:
This chemical may cause damage to health and may cause inflammation to the skin or other mucous membranes. It is harmful if swallowed. In addition, this chemical may cause sensitisation by skin contact. Whenever you will contact it, please wear suitable protective clothing and gloves.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(NC)Cc1ccc(N)cc1
(2)InChI: InChI=1/C8H12N2O2S/c1-10-13(11,12)6-7-2-4-8(9)5-3-7/h2-5,10H,6,9H2,1H3
(3)InChIKey: CIWNHTXCBHTWRV-UHFFFAOYAU

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