2,5-Dibromothieno[3,2-b]thiophene supplier

Name
2,5-DIBROMOTHIENO[3,2-B]THIOPHENE
EINECS
CAS No. 25121-87-3
Article Data26
CAS DataBase
Density 2.21 g/cm³
Solubility
Melting Point 130 °C
Formula C₆H₂Br₂S₂
Boiling Point 346.695 °C at 760 mmHg
Molecular Weight 298.022
Flash Point 163.475 °C
Transport Information
Appearance
Safety
Risk Codes 22
Molecular Structure
Hazard Symbols Xn
Synonyms 2,5-dibromo-thieno[3,2-b]thiophene;
PSA 56.48000
LogP 4.48780

2,5-Dibromothieno[3,2-b]thiophene Specification

The CAS register number of 2,5-Dibromothieno[3,2-b]thiophene is 25121-87-3. It also can be called as Thieno[3,2-b]thiophene,2,5-dibromo- and the IUPAC name about this chemical is 2,5-dibromothieno[3,2-b]thiophene. The molecular formula about this chemical is C₆H₂Br₂S₂and the molecular weight is 298.02.

Physical properties about 2,5-Dibromothieno[3,2-b]thiophene are: (1)ACD/LogP: 6.85; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.85; (4)ACD/LogD (pH 7.4): 6.85; (5)ACD/BCF (pH 5.5): 95363.05; (6)ACD/BCF (pH 7.4): 95363.05; (7)ACD/KOC (pH 5.5): 127590.9; (8)ACD/KOC (pH 7.4): 127590.9; (9)Polar Surface Area: 56.48Å²; (10)Index of Refraction: 1.773; (11)Molar Refractivity: 56.24 cm³; (12)Molar Volume: 134.8 cm³; (13)Polarizability: 22.29x10^-24cm³; (14)Surface Tension: 61.9 dyne/cm; (15)Enthalpy of Vaporization: 56.75 kJ/mol; (16)Boiling Point: 346.7 °C at 760 mmHg; (17)Vapour Pressure: 0.000113 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc2sc1cc(Br)sc1c2
(2)InChI: InChI=1/C6H2Br2S2/c7-5-1-3-4(10-5)2-6(8)9-3/h1-2H
(3)InChIKey: APDAUBNBDJUQGW-UHFFFAOYAS

Product Name

2,5-DIBROMOTHIENO[3,2-B]THIOPHENE

2,5-Dibromothieno[3,2-b]thiophene Specification

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