N-benzyl-3-bromobenzenesulfonamide supplier

Name
N-BENZYL 3-BROMOBENZENESULFONAMIDE
EINECS
CAS No. 625470-36-2
Article Data4
CAS DataBase
Density 1.503 g/cm³
Solubility
Melting Point 78-82 °C
Formula C₁₃H₁₂BrNO₂S
Boiling Point 457.9 °C at 760 mmHg
Molecular Weight 326.214
Flash Point 230.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms N-Benzyl-3-bromobenzenesulfonamide;
PSA 54.55000
LogP 4.39930

N-benzyl-3-bromobenzenesulfonamide Specification

This chemical is called N-benzyl-3-bromobenzenesulfonamide, and its CAS registry number is 625470-36-2. With the molecular formula of C₁₃H₁₂BrNO₂S, its molecular weight is 326.21. Additionally, its product categories are Blocks; Bromides; Sulfonamides.

Other characteristics of the N-benzyl-3-bromobenzenesulfonamide can be summarised as followings: (1)ACD/LogP: 3.89; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 45.76 Å²; (7)Index of Refraction: 1.62; (8)Molar Refractivity: 76.28 cm³; (9)Molar Volume: 216.9 cm³; (10)Polarizability: 30.24×10^-24cm³; (11)Surface Tension: 49.8 dyne/cm; (12)Density: 1.503 g/cm³; (13)Flash Point: 230.7 °C; (14)Enthalpy of Vaporization: 71.81 kJ/mol; (15)Boiling Point: 457.9 °C at 760 mmHg; (16)Vapour Pressure: 1.44E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=S(=O)(c1cc(Br)ccc1)NCc2ccccc2
2.InChI: InChI=1/C13H12BrNO2S/c14-12-7-4-8-13(9-12)18(16,17)15-10-11-5-2-1-3-6-11/h1-9,15H,10H2
3.InChIKey: HTAWYJSLZQALKS-UHFFFAOYAX

Product Name

N-BENZYL 3-BROMOBENZENESULFONAMIDE

N-benzyl-3-bromobenzenesulfonamide Specification

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