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Ethanone, 2-bromo-1-(5-bromo-2-hydroxyphenyl)-

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Name

Ethanone, 2-bromo-1-(5-bromo-2-hydroxyphenyl)-

EINECS N/A
CAS No. 67029-74-7 Density 1.975 g/cm3
PSA 37.30000 LogP 2.73230
Solubility N/A Melting Point 66-70 °C
Formula C8H6Br2O2 Boiling Point 331.5 °C at 760 mmHg
Molecular Weight 293.942 Flash Point 154.3 °C
Transport Information UN 2811 Appearance N/A
Safety 26-45 Risk Codes 25-36/37/38
Molecular Structure Molecular Structure of 67029-74-7 (2-BROMO-1-(5-BROMO-2-HYDROXYPHENYL)ETHANONE) Hazard Symbols ToxicT
Synonyms

2-Bromo-1-(5-bromo-2-hydroxyphenyl)ethan-1-one;

Article Data 10

Ethanone, 2-bromo-1-(5-bromo-2-hydroxyphenyl)- Specification

The Ethanone, 2-bromo-1-(5-bromo-2-hydroxyphenyl)-, with the CAS registry number 67029-74-7, is also known as 2-Bromo-1-(5-bromo-2-hydroxyphenyl)ethan-1-one. This chemical's molecular formula is C8H6Br2O2 and molecular weight is 293.94. What's more, its IUPAC name is 2-Bromo-1-(5-bromo-2-hydroxyphenyl)ethanone.

Physical properties about Ethanone, 2-bromo-1-(5-bromo-2-hydroxyphenyl)- are: (1)ACD/LogP: 3.64; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.62; (4)ACD/LogD (pH 7.4): 3.04; (5)ACD/BCF (pH 5.5): 329.74; (6)ACD/BCF (pH 7.4): 85.66; (7)ACD/KOC (pH 5.5): 2185.41; (8)ACD/KOC (pH 7.4): 567.73; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 26.3 Å2; (13)Index of Refraction: 1.639; (14)Molar Refractivity: 53.58 cm3; (15)Molar Volume: 148.7 cm3; (16)Polarizability: 21.24×10-24 cm3; (17)Surface Tension: 57.7 dyne/cm; (18)Density: 1.975 g/cm3; (19)Flash Point: 154.3 °C; (20)Enthalpy of Vaporization: 59.7 kJ/mol; (21)Boiling Point: 331.5 °C at 760 mmHg; (22)Vapour Pressure: 8.04E-05 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. In addition, this chemical is toxic if swallowed. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. And in case of accident or if you feel unwell seek medical advice immediately (show the label where possible).

You can still convert the following datas into molecular structure:
(1) SMILES: Brc1cc(C(=O)CBr)c(O)cc1
(2) InChI: InChI=1/C8H6Br2O2/c9-4-8(12)6-3-5(10)1-2-7(6)11/h1-3,11H,4H2
(3) InChIKey: FZIUHYVCSFQKFC-UHFFFAOYAZ

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