2-Chloro-6-cyanopyrazine supplier

Name
6-chloropyrazine-2-carbonitrile
EINECS
CAS No. 6863-74-7
Article Data4
CAS DataBase
Density 1.438 g/cm³
Solubility 9.66 mg/mL in water at 25 ºC
Melting Point 24-26ºC
Formula C₅H₂ClN₃
Boiling Point 229.354 °C at 760 mmHg
Molecular Weight 139.544
Flash Point 92.51 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Pyrazinecarbonitrile,6-chloro- (7CI,8CI,9CI);2-Chloro-6-cyanopyrazine;2-Chloro-6-pyrazinecarbonitrile;2-Cyano-6-chloropyrazine;6-Chloro-2-cyanopyrazine;6-Chloro-2-pyrazinecarbonitrile;6-Chloropyrazine-2-carbonitrile;
PSA
LogP

2-Chloro-6-cyanopyrazine Specification

The 2-Chloro-6-cyanopyrazine, with the CAS registry number 6863-74-7, is also known as 2-Chloro-6-cyanopyrazine. It belongs to the product categories of Building Blocks; Pyrazine. This chemical's molecular formula is C₅H₂ClN₃ and formula weight is 139.54. What's more, its systematic name is 6-chloropyrazine-2-carbonitrile.

Physical properties of 2-Chloro-6-cyanopyrazine are: (1)ACD/LogP: 0.71; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.709; (4)ACD/BCF (pH 5.5): 2.035; (5)ACD/KOC (pH 5.5): 57.87; (6)#H bond acceptors: 3; (7)#H bond donors: 0; (8)Polar Surface Area: 49.57 Å²; (9)Index of Refraction: 1.568; (10)Molar Refractivity: 31.745 cm³; (11)Molar Volume: 97.011 cm³; (12)Surface Tension: 70.653 dyne/cm; (13)Density: 1.438 g/cm³; (14)Flash Point: 92.51 °C; (15)Enthalpy of Vaporization: 46.597 kJ/mol; (16)Boiling Point: 229.354 °C at 760 mmHg; (17)Vapour Pressure: 0.07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=C(N=C(C=N1)Cl)C#N
(2)InChI: InChI=1S/C5H2ClN3/c6-5-3-8-2-4(1-7)9-5/h2-3H
(3)InChIKey: CZPOFSDHJNNWQL-UHFFFAOYSA-N

Product Name

6-chloropyrazine-2-carbonitrile

2-Chloro-6-cyanopyrazine Specification

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