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104144-06-1

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Basic Information
CAS No.: 104144-06-1
Name: Benzenesulfonamide, N,N-di-3-buten-1-yl-4-methyl-
Article Data: 6
Molecular Structure:
Molecular Structure of 104144-06-1 (Benzenesulfonamide, N,N-di-3-buten-1-yl-4-methyl-)
Formula: C15H21NO2S
Molecular Weight: 279.403
Synonyms: Benzenesulfonamide,N,N-di-3-butenyl-4-methyl- (9CI);N,N-Bis(3-buten-1-yl)-p-toluenesulfonamide;N,N-Bis(3-butenyl)-4-methylbenzenesulfonamide;
Density: 1.073 g/cm3
Boiling Point: 387.271 °C at 760 mmHg
Flash Point: 188.015 °C
PSA: 45.76000
LogP: 4.21870
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Specification

The CAS registry number of Benzenesulfonamide,N,N-di-3-buten-1-yl-4-methyl- is 104144-06-1. This chemical is also named as N,N-Bis(3-butenyl)-4-methylbenzenesulfonamide. In addition, its molecular formula is C15H21NO2S and molecular weight is 279.3977. Its systematic name is called N,N-di(but-3-en-1-yl)-4-methylbenzenesulfonamide.

Physical properties about Benzenesulfonamide,N,N-di-3-buten-1-yl-4-methyl- are: (1)ACD/LogP: 4.21; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4; (4)ACD/LogD (pH 7.4): 4; (5)ACD/BCF (pH 5.5): 1465; (6)ACD/BCF (pH 7.4): 1465; (7)ACD/KOC (pH 5.5): 6422; (8)ACD/KOC (pH 7.4): 6422; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 8; (12)Index of Refraction: 1.532; (13)Molar Refractivity: 80.656 cm3; (14)Molar Volume: 260.474 cm3; (15)Surface Tension: 38.007 dyne/cm; (16)Density: 1.073 g/cm3; (17)Flash Point: 188.015 °C; (18)Enthalpy of Vaporization: 63.632 kJ/mol; (19)Boiling Point: 387.271 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(c1ccc(cc1)C)N(CC\C=C)CC\C=C
(2)InChI: InChI=1/C15H21NO2S/c1-4-6-12-16(13-7-5-2)19(17,18)15-10-8-14(3)9-11-15/h4-5,8-11H,1-2,6-7,12-13H2,3H3
(3)InChIKey: PYKYBMYSBJLKEU-UHFFFAOYAE