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2,4-Dibromothiophene

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Name

2,4-Dibromothiophene

EINECS 678-717-9
CAS No. 3140-92-9 Density 2.174 g/cm3
PSA 28.24000 LogP 3.27310
Solubility It is insoluble in water. Melting Point -26.3°C
Formula C4H2Br2S Boiling Point 213.4 °C at 760 mmHg
Molecular Weight 241.934 Flash Point 82.9 °C
Transport Information UN 2810 Appearance clear colorless to light brown liquid
Safety 36/37/39-26-36 Risk Codes 36/37/38-20/21/22
Molecular Structure Molecular Structure of 3140-92-9 (2,4-Dibromothiophene) Hazard Symbols HarmfulXn, IrritantXi
Synonyms

2,4-DIBROMOTHIOPHENE;2,4-Dibromothiophene,94%;2,4-DIBROMOTHIOPHENE, 90+%;2,4-DIBROMOTHIOPHENE 96%;2,4-DIBROMOTHIOPHENE,96%

Article Data 7

2,4-Dibromothiophene Specification

The 2,4-Dibromothiophene is an organic compound with the formula C4H2Br2S. The IUPAC name of this chemical is 2,4-dibromothiophene. With the CAS registry number 3140-92-9, it is also named as thiophene, 2,4-dibromo-. The product's categories are Thiophene & Benzothiophene; Thiophens. Besides, it is a clear colorless to light brown liquid, which should be stored in a cool and dry place.

Physical properties about 2,4-Dibromothiophene are: (1)ACD/LogP: 3.43 ; (2)ACD/LogD (pH 5.5): 3.43; (3)ACD/LogD (pH 7.4): 3.43; (4)ACD/BCF (pH 5.5): 236.09; (5)ACD/BCF (pH 7.4): 236.09; (6)ACD/KOC (pH 5.5): 1738.8; (7)ACD/KOC (pH 7.4): 1738.8; (8)Polar Surface Area: 28.24 Å2; (9)Index of Refraction: 1.638; (10)Molar Refractivity: 40.01 cm3; (11)Molar Volume: 111.2 cm3; (12)Polarizability: 15.86×10-24cm3; (13)Surface Tension: 47 dyne/cm; (14)Density: 2.174 g/cm3; (15)Flash Point: 82.9 °C; (16)Enthalpy of Vaporization: 43.14 kJ/mol; (17)Boiling Point: 213.4 °C at 760 mmHg; (18)Vapour Pressure: 0.24 mmHg at 25°C.

Preparation: this chemical can be prepared by 2,3,5-tribromo-thiophene. This reaction will need reagent NaBH4 and solvent dimethylsulfoxide. The reaction time is 4 hours with reaction temperature of 26 °C. The yield is about 87.5%.



Uses of 2,4-Dibromothiophene: it can be used to produce 1-(3',5'-dibromo-[2,2']bithiophenyl-5-yl)-ethanone. It will need reagent acetonitrile with reaction time of 3 hours. The yield is about 99.8%.

When you are using this chemical, please be cautious about it as the following:
It is harmful by inhalation, in contact with skin and if swallowed. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides, this chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1csc(Br)c1
(2)InChI: InChI=1/C4H2Br2S/c5-3-1-4(6)7-2-3/h1-2H
(3)InChIKey: WAQFYSJKIRRXLP-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C4H2Br2S/c5-3-1-4(6)7-2-3/h1-2H
(5)Std. InChIKey: WAQFYSJKIRRXLP-UHFFFAOYSA-N

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