Benzenesulfonamide,4-bromo-N-cyclohexyl- supplier

Name
4-BROMO-N-CYCLOHEXYLBENZENESULPHONAMIDE
EINECS
CAS No. 7454-76-4
Article Data13
CAS DataBase
Density 1.5 g/cm³
Solubility
Melting Point 102-104
Formula C₁₂H₁₆BrNO₂S
Boiling Point 413.7 °C at 760 mmHg
Molecular Weight 318.235
Flash Point 204 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms Benzenesulfonamide,p-bromo-N-cyclohexyl- (7CI,8CI);4-Bromo-N-cyclohexylbenzenesulfonamide;[(4-bromophenyl)sulfonyl]cyclohexylamine;
PSA 54.55000
LogP 4.53180

Benzenesulfonamide,4-bromo-N-cyclohexyl- Specification

The Benzenesulfonamide,4-bromo-N-cyclohexyl-, with the CAS registry number 7454-76-4, has the systematic name of 4-bromo-N-cyclohexylbenzenesulfonamide. It belongs to the following product categories: Blocks; Bromides; Sulfonamides. And the molecular formula of the chemical is C₁₂H₁₆BrNO₂S.

The characteristics of Benzenesulfonamide,4-bromo-N-cyclohexyl- are as followings: (1)ACD/LogP: 4.07; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 45.76 Å²; (7)Index of Refraction: 1.605; (8)Molar Refractivity: 72.66 cm³; (9)Molar Volume: 210.9 cm³; (10)Polarizability: 28.8×10^-24cm³; (11)Surface Tension: 53.9 dyne/cm; (12)Density: 1.5 g/cm³; (13)Flash Point: 204 °C; (14)Enthalpy of Vaporization: 66.65 kJ/mol; (15)Boiling Point: 413.7 °C at 760 mmHg; (16)Vapour Pressure: 4.72E-07 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=S(=O)(NC1CCCCC1)c2ccc(Br)cc2
(2)InChI: InChI=1/C12H16BrNO2S/c13-10-6-8-12(9-7-10)17(15,16)14-11-4-2-1-3-5-11/h6-9,11,14H,1-5H2
(3)InChIKey: XATZMSCJHBJRTQ-UHFFFAOYAM

Product Name

4-BROMO-N-CYCLOHEXYLBENZENESULPHONAMIDE

Benzenesulfonamide,4-bromo-N-cyclohexyl- Specification

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