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3141-25-1

Basic Information
CAS No.: 3141-25-1
Name: 2,3,4-Tribromothiophene
Article Data: 11
Molecular Structure:
Molecular Structure of 3141-25-1 (2,3,4-Tribromothiophene)
Formula: C4HBr3S
Molecular Weight: 320.83
Synonyms: 2,3,4-Tribromothiophene;Tribromothiophene;
EINECS: 221-545-2
Density: 2.516g/cm3
Melting Point: 43-45°C
Boiling Point: 277.5 °C at 760 mmHg
Flash Point: 121.6 °C
Appearance: white to light yellow crystal powder
Hazard Symbols: IrritantXi
Risk Codes: 20/21/22
Safety: 22-36/37
PSA: 28.24000
LogP: 4.03560
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Specification

The 2,3,4-Tribromothiophene with the CAS number 3141-25-1 is also called Thiophene,2,3,4-tribromo-. Its EINECS registry number is 221-545-2. The molecular formula is C4HBr3S. The product category is Thiophene&Benzothiophene. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP: 3.88; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.88; (4)ACD/LogD (pH 7.4): 3.88; (5)ACD/BCF (pH 5.5): 525.42; (6)ACD/BCF (pH 7.4): 525.42; (7)ACD/KOC (pH 5.5): 3082.79; (8)ACD/KOC (pH 7.4): 3082.79; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 28.24 Å2; (13)Index of Refraction: 1.671; (14)Molar Refractivity: 47.7 cm3; (15)Molar Volume: 127.4 cm3; (16)Polarizability: 18.91×10-24cm3; (17)Surface Tension: 51.7 dyne/cm; (18)Enthalpy of Vaporization: 49.53 kJ/mol; (19)Vapour Pressure: 0.00762 mmHg at 25°C.

While using this chemical, you should be very cautious. This chemical is harmful by inhalation, in contact with skin and if swallowed. Therefore, you should take the following instructions. Firstly, you should wear suitable protective clothing, gloves and eye/face protection. Then you should not breathe dust..

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1csc(Br)c1Br
(2)InChI: InChI=1/C4HBr3S/c5-2-1-8-4(7)3(2)6/h1H
(3)InChIKey: ZDXQFDMBZUQHOM-UHFFFAOYAL