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2-(Bromomethyl)-5-(trifluoromethyl)furan

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Name

2-(Bromomethyl)-5-(trifluoromethyl)furan

EINECS N/A
CAS No. 17515-77-4 Density 1.693 g/cm3
PSA 13.14000 LogP 3.19330
Solubility N/A Melting Point N/A
Formula C6H4BrF3O Boiling Point 174.3 °C at 760 mmHg
Molecular Weight 228.996 Flash Point 59.2 °C
Transport Information UN 1760 Appearance N/A
Safety 26-36/37/39-45 Risk Codes 34-36/37/38
Molecular Structure Molecular Structure of 17515-77-4 (2-(Bromomethyl)-5-(trifluoromethyl)furan) Hazard Symbols CorrosiveC
Synonyms

2-(3-FLUORO-PHENYL)-ETHANESULFONYL CHLORIDE;2-trifluoromethyl-5-bromomethyl furan;2-bromomethyl-5-trifluoromethylfuran;2-bromomethyl-5-trifluoromethyl-furane;2-(bromomethyl)-5-(trifluromethyl)furan;

Article Data 1

2-(Bromomethyl)-5-(trifluoromethyl)furan Specification

The IUPAC name of this chemical is 2-(Bromomethyl)-5-(trifluoromethyl)furan. With the CAS registry number 17515-77-4, it is also named as furan,2-(bromomethyl)-5-(trifluoromethyl)-. In addition, the molecular formula is C6H4BrF3O and the molecular weight is 228.99. It should be stored in a cool and dry place.

Physical properties about 2-(Bromomethyl)-5-(trifluoromethyl)furan are: (1)ACD/LogP: 2.65; (2)ACD/LogD (pH 5.5): 2.65; (3)ACD/LogD (pH 7.4): 2.65; (4)ACD/BCF (pH 5.5): 61.02; (5)ACD/BCF (pH 7.4): 61.02; (6)ACD/KOC (pH 5.5): 660.18; (7)ACD/KOC (pH 7.4): 660.18; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 13.14 Å2; (11)Index of Refraction: 1.447; (12)Molar Refractivity: 36.18 cm3; (13)Molar Volume: 135.2 cm3; (14)Polarizability: 14.34 ×10-24cm3; (15)Surface Tension: 26.7 dyne/cm; (16)Density: 1.693 g/cm3; (17)Flash Point: 59.2 °C; (18)Enthalpy of Vaporization: 39.37 kJ/mol; (19)Boiling Point: 174.3 °C at 760 mmHg; (20)Vapour Pressure: 1.63 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical can cause burns. It is irritating to eyes, respiratory system and skin. During using it, wear suitable protective clothing, gloves and eye/face protection. 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 whenever possible.).

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c1oc(cc1)CBr
(2)Std. InChI: InChI=1S/C6H4BrF3O/c7-3-4-1-2-5(11-4)6(8,9)10/h1-2H,3H2
(3)Std. InChIKey: YNHVBNGRNNVEMD-UHFFFAOYSA-N

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