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CAS No.: | 443904-59-4 |
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Name: | 1-(2,4-dichlorophenylsulfonyl)piperidine |
Molecular Structure: | |
Formula: | C11H13Cl2NO2S |
Molecular Weight: | 293.00 |
Synonyms: | Piperidine, 1-[(2,4-dichlorophenyl)sulfonyl]-; |
Density: | 1.409 g/cm3 |
Boiling Point: | 410.9 °C at 760 mmHg |
Flash Point: | 202.3 °C |
PSA: | 45.76000 |
LogP: | 4.18670 |
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This product is an organic compound with the formula C11H13Cl2NO2S. The systematic name of this chemical is 1-[(2,4-Dichlorophenyl)sulfonyl]piperidine. With the CAS registry number 443904-59-4, it is also named as Piperidine, 1-[(2,4-dichlorophenyl)sulfonyl]-. In addition, the molecular weight is 293.00.
Physical properties of 1-[(2,4-Dichlorophenyl)sulfonyl]piperidine are: (1)ACD/LogP: 3.58; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 45.76 Å2; (7)Index of Refraction: 1.587; (8)Molar Refractivity: 70.21 cm3; (9)Molar Volume: 208.6 cm3; (10)Polarizability: 27.83×10-24cm3; (11)Surface Tension: 49.9 dyne/cm; (12)Density: 1.409 g/cm3; (13)Flash Point: 202.3 °C; (14)Enthalpy of Vaporization: 66.33 kJ/mol; (15)Boiling Point: 410.9 °C at 760 mmHg; (16)Vapour Pressure: 5.82E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(c1ccc(Cl)cc1Cl)N2CCCCC2
(2)InChI: InChI=1S/C11H13Cl2NO2S/c12-9-4-5-11(10(13)8-9)17(15,16)14-6-2-1-3-7-14/h4-5,8H,1-3,6-7H2
(3)InChIKey: RLTFPOFZJVKHPY-UHFFFAOYSA-N