Home >> Chemicals Listing >> hot product list by B  

Benzenecarbothioamide,3-bromo-4-(2-methylpropoxy)- (208665-96-7)

Identification
Name:Benzenecarbothioamide,3-bromo-4-(2-methylpropoxy)-
Synonyms:3-Bromo-4-isobutoxybenzothioamide
CAS:208665-96-7
Molecular Formula: C11H14 Br N O S
Molecular Weight: 288.20
InChI: InChI=1/C11H14BrNOS/c1-7(2)6-14-10-4-3-8(11(13)15)5-9(10)12/h3-5,7H,6H2,1-2H3,(H2,13,15)
Molecular Structure: (C11H14BrNOS) 3-Bromo-4-isobutoxybenzothioamide
Properties
Density:1.398 g/cm3
Refractive index:1.602
Specification:

The 3-Bromo-4-isobutoxybenzothioamide with the cas number 208665-96-7, is also called benzenecarbothioamide, 3-bromo-4-(2-methylpropoxy)-. The properties of the chemical are: (1)#H bond acceptors: 2; (2)#H bond donors: 2; (3)#Freely Rotating Bonds: 4; (4)Polar Surface Area: 67.34Å2; (5)Index of Refraction: 1.602; (6)Molar Refractivity: 70.669 cm3; (7)Molar Volume: 206.087 cm3; (8)Polarizability:28.015×10-24cm; (9)Surface Tension: 49.663 dyne/cm; (10)Enthalpy of Vaporization: 61.772 kJ/mol; (11)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)COc1ccc(cc1Br)C(=S)N
(2)InChI: InChI=1/C11H14BrNOS/c1-7(2)6-14-10-4-3-8(11(13)15)5-9(10)12/h3-5,7H,6H2,1-2H3,(H2,13,15)

Safety Data