Hexane, 2-bromo- (3377-86-4)

The 2-Bromohexane with the CAS number 3377-86-4 is also called Hexane, 2-bromo-. Its EINECS registry number is 222-173-3. The molecular formula is C₆H₁₃Br. This chemical is clear pale yellow liquid. It is a kind of organics.

The properties of the chemical are: (1)ACD/LogP: 3.62; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.62; (4)ACD/LogD (pH 7.4): 3.62; (5)ACD/BCF (pH 5.5): 332.55; (6)ACD/BCF (pH 7.4): 332.55; (7)ACD/KOC (pH 5.5): 2222.03; (8)ACD/KOC (pH 7.4): 2222.03; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 0 Å²; (13)Index of Refraction: 1.444; (14)Molar Refractivity: 37.53 cm³; (15)Molar Volume: 141.1 cm³; (16)Polarizability: 14.88×10^-24cm³; (17)Surface Tension: 26.5 dyne/cm; (18)Enthalpy of Vaporization: 36.54 kJ/mol; (19)Vapour Pressure: 6.54 mmHg at 25°C.

While using this chemical, you should be very cautious. This chemical is flammable. Therefore, you should take the following instructions. Firstly, you should not breathe vapour. Then you should avoid this chemical contact with skin and eyes.

You can still convert the following datas into molecular structure:
(1)SMILES: BrC(C)CCCC
(2)InChI: InChI=1/C6H13Br/c1-3-4-5-6(2)7/h6H,3-5H2,1-2H3
(3)InChIKey: NEBYCXAKZCQWAW-UHFFFAOYAX