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| CAS No.: | 115562-53-3 |
|---|---|
| Name: | N-(4-AMINOBENZYL)-N-METHYL-P-TOLUENESULFONAMIDE |
| Article Data: | 1 |
| Molecular Structure: | |
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| Formula: | C15H18N2O2S |
| Molecular Weight: | 290.38 |
| Synonyms: | N-(4-AMINOBENZYL)-N-METHYL-P-TOLUENESULFONAMIDE;N-(4-Aminobenzyl)-N,4-dimethylbenzenesulfonamide |
| Density: | 1.24 g/cm3 |
| Boiling Point: | 475.531 °C at 760 mmHg |
| Flash Point: | 241.393 °C |
| PSA: | 71.78000 |
| LogP: | 4.05990 |
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Specification
This chemical is called Benzenesulfonamide,N-[(4-aminophenyl)methyl]-N,4-dimethyl-, and its systematic name is N-[(4-aminophenyl)methyl]-N,4-dimethyl-benzenesulfonamide. With the molecular formula of C15H18N2O2S, its molecular weight is 290.38. The CAS registry number of this chemical is 115562-53-3.
Other characteristics of the Benzenesulfonamide,N-[(4-aminophenyl)methyl]-N,4-dimethyl- can be summarised as followings: (1)ACD/LogP: 2.41; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.38; (4)ACD/LogD (pH 7.4): 2.41 ; (5)#H bond acceptors: 4; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 5; (8)Polar Surface Area: 71.78 Å2; (9)Index of Refraction: 1.614; (10)Molar Refractivity: 81.66 cm3; (11)Molar Volume: 234.2 cm3; (12)Polarizability: 32.37×10-24cm3; (13)Surface Tension: 52.2 dyne/cm; (14)Density: 1.239 g/cm3; (15)Flash Point: 241.4 °C; (16)Enthalpy of Vaporization: 73.91 kJ/mol; (17)Boiling Point: 475.5 °C at 760 mmHg; (18)Vapour Pressure: 3.29E-09 mmHg at 25°C.
Production method of this chemical: The Benzenesulfonamide,N-[(4-aminophenyl)methyl]-N,4-dimethyl- could be obtained by the reactant of N-methyl-N-(4-nitro-benzyl)-toluene-4-sulfonamide. This reaction needs the reagents of Sn, HCl, and the solvent of aq. ethanol. The yield is76 %. In addition, this reaction needs the condition of heating.
![The Benzenesulfonamide,N-[(4-aminophenyl)methyl]-N,4-dimethyl- could be obtained by the reactant of N-methyl-N-(4-nitro-benzyl)-toluene-4-sulfonamide](/UserFilesUpload/production method of Benzenesulfonamide,N-[(4-aminophenyl)methyl]-N,4-dimethyl-.jpg)
You can still convert the following datas into molecular structure:
1.SMILES: Nc2ccc(CN(C)S(=O)(=O)c1ccc(C)cc1)cc2
2.InChI: InChI=1/C15H18N2O2S/c1-12-3-9-15(10-4-12)20(18,19)17(2)11-13-5-7-14(16)8-6-13/h3-10H,11,16H2,1-2H3
3.InChIKey: UBUUFWMIYYCCAI-UHFFFAOYAL