2,5-Dimethylterephthalonitrile supplier

Name
2,5-Dimethylterephthalonitrile
EINECS 630-986-3
CAS No. 39095-25-5
Article Data17
CAS DataBase
Density 1.09 g/cm³
Solubility
Melting Point 212 °C
Formula C₁₀H₈N₂
Boiling Point 337.5 °C at 760 mmHg
Molecular Weight 156.187
Flash Point 166 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1,4-Benzenedicarbonitrile, 2,5-dimethyl-;
PSA 47.58000
LogP 2.04676

2,5-Dimethylterephthalonitrile Specification

The 2,5-Dimethylterephthalonitrile, with the CAS registry number 39095-25-5, is also known as 1,4-Benzenedicarbonitrile, 2,5-dimethyl-. This chemical's molecular formula is C₁₀H₈N₂ and molecular weight is 156.18. Its systematic name is called 2,5-dimethylbenzene-1,4-dicarbonitrile.

Physical properties of 2,5-Dimethylterephthalonitrile: (1)ACD/LogP: 1.89; (2)ACD/LogD (pH 5.5): 1.89; (3)ACD/LogD (pH 7.4): 1.89; (4)ACD/BCF (pH 5.5): 16.08; (5)ACD/BCF (pH 7.4): 16.08; (6)ACD/KOC (pH 5.5): 254.13; (7)ACD/KOC (pH 7.4): 254.13; (8)#H bond acceptors: 2; (9)Index of Refraction: 1.547; (10)Molar Refractivity: 45.13 cm³; (11)Molar Volume: 142.1 cm³; (12)Surface Tension: 49.5 dyne/cm; (13)Density: 1.09 g/cm³; (14)Flash Point: 166 °C; (15)Enthalpy of Vaporization: 58.08 kJ/mol; (16)Boiling Point: 337.5 °C at 760 mmHg; (17)Vapour Pressure: 0.000104 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: N#Cc1cc(c(C#N)cc1C)C
(2)InChI: InChI=1/C10H8N2/c1-7-3-10(6-12)8(2)4-9(7)5-11/h3-4H,1-2H3
(3)InChIKey: ZSJIRGBDYMYVDO-UHFFFAOYAW

Product Name

2,5-Dimethylterephthalonitrile

2,5-Dimethylterephthalonitrile Specification

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