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2-Bromooctanoyl bromide

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Name

2-Bromooctanoyl bromide

EINECS N/A
CAS No. 106265-08-1 Density 1.551 g/cm3
PSA 17.07000 LogP 3.64180
Solubility N/A Melting Point N/A
Formula C8H14Br2O Boiling Point 255.86 °C at 760 mmHg
Molecular Weight 286.007 Flash Point 61.136 °C
Transport Information N/A Appearance colourless to light yellow oily transparent liquid
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 106265-08-1 (2-bromooctanoyl bromide) Hazard Symbols N/A
Synonyms

2-Bromooctanoylbromide;

 

2-Bromooctanoyl bromide Specification

The 2-Bromooctanoyl bromide, with the CAS registry number 106265-08-1, is also known as Octanoyl bromide,2-bromo-. This chemical's molecular formula is C8H14Br2O and molecular weight is 286.00. What's more, its systematic name is 2-Bromooctanoyl bromide.

Physical properties of 2-Bromooctanoyl bromide are: (1)ACD/LogP: 4.041; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.04; (4)ACD/LogD (pH 7.4): 4.04; (5)ACD/BCF (pH 5.5): 693.83; (6)ACD/BCF (pH 7.4): 693.83; (7)ACD/KOC (pH 5.5): 3761.59; (8)ACD/KOC (pH 7.4): 3761.59; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 17.07 Å2; (13)Index of Refraction: 1.503; (14)Molar Refractivity: 54.564 cm3; (15)Molar Volume: 184.449 cm3; (16)Polarizability: 21.631×10-24cm3; (17)Surface Tension: 37.7 dyne/cm; (18)Density: 1.551 g/cm3; (19)Flash Point: 61.136 °C; (20)Enthalpy of Vaporization: 49.335 kJ/mol; (21)Boiling Point: 255.86 °C at 760 mmHg; (22)Vapour Pressure: 0.02 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CCCCCCC(Br)C(Br)=O
(2)Std. InChI: InChI=1S/C8H14Br2O/c1-2-3-4-5-6-7(9)8(10)11/h7H,2-6H2,1H3
(3)Std. InChIKey: QEJYOKHMHBRARP-UHFFFAOYSA-N 

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