Products Categories
CAS No.: | 625470-36-2 |
---|---|
Name: | N-BENZYL 3-BROMOBENZENESULFONAMIDE |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C13H12BrNO2S |
Molecular Weight: | 326.214 |
Synonyms: | N-Benzyl-3-bromobenzenesulfonamide; |
Density: | 1.503 g/cm3 |
Melting Point: | 78-82 °C |
Boiling Point: | 457.9 °C at 760 mmHg |
Flash Point: | 230.7 °C |
Hazard Symbols: | Xi |
PSA: | 54.55000 |
LogP: | 4.39930 |
What can I do for you?
Get Best Price
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