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Thiophene-2,3-dicarbonitrile

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Name

Thiophene-2,3-dicarbonitrile

EINECS N/A
CAS No. 18853-42-4 Density 1.34 g/cm3
PSA 75.82000 LogP 1.49146
Solubility N/A Melting Point 115-122℃
Formula C6H2N2S Boiling Point 336.3 °C at 760 mmHg
Molecular Weight 134.16 Flash Point 157.2 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 18853-42-4 (thiophene-2,3-
dicarbonitrile) Hazard Symbols N/A
Synonyms

2,3-Thiophenedicarbonitrile;

Article Data 3

Thiophene-2,3-dicarbonitrile Specification

This chemical is called Thiophene-2,3-dicarbonitrile, and its systematic name is 2,3-Thiophenedicarbonitrile. With the molecular formula of C6H2N2S, its molecular weight is 134.16. The CAS registry number of this chemical is 18853-42-4.

Other characteristics of the Thiophene-2,3-dicarbonitrile can be summarised as followings: (1)ACD/LogP: 0.69; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 75.82 Å2; (7)Index of Refraction: 1.596; (8)Molar Refractivity: 34.02 cm3; (9)Molar Volume: 99.9 cm3; (10)Polarizability: 13.49×10-24cm3; (11)Surface Tension: 66.5 dyne/cm; (12)Density: 1.34 g/cm3; (13)Flash Point: 157.2 °C; (14)Enthalpy of Vaporization: 57.95 kJ/mol; (15)Boiling Point: 336.3 °C at 760 mmHg; (16)Vapour Pressure: 0.000113 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: N#Cc1sccc1C#N
2.InChI: InChI=1/C6H2N2S/c7-3-5-1-2-9-6(5)4-8/h1-2H
3.InChIKey: FDLABKBUOMBKLS-UHFFFAOYAK

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