2-Bromohexane supplier | CasNO.3377-86-4

Name
2-BROMOHEXANE
EINECS 222-173-3
CAS No. 3377-86-4
Article Data45
CAS DataBase
Density 1.169 g/cm³
Solubility Not miscible in water.
Melting Point -44.22°C (estimate)
Formula C6H13 Br
Boiling Point 144 °C at 760 mmHg
Molecular Weight 165.073
Flash Point 40.1 °C
Transport Information UN1993
Appearance Clear pale yellow liquid
Safety 23-24/25
Risk Codes 10
Molecular Structure
Hazard Symbols R10:Flammable.;
Synonyms (?à)-2-Bromohexane;1-Methylpentan-1-yl bromide;2-Bromohexane;2-Hexyl bromide;
PSA 0.00000
LogP 2.96000

2-Bromohexane Specification

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

Product Name

2-BROMOHEXANE

2-Bromohexane Specification

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