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CAS No.: | 35590-37-5 |
---|---|
Name: | 5-Bromonicotinonitrile |
Article Data: | 11 |
Molecular Structure: | |
Formula: | C6H3BrN2 |
Molecular Weight: | 183.007 |
Synonyms: | 3-Bromo-5-cyanopyridine;3-Bromopyridine-5-carbonitrile;3-Cyano-5-bromopyridine;5-Bromo-3-cyanopyridine;5-Bromo-3-pyridinecarbonitrile; |
Density: | 1.72 g/cm3 |
Melting Point: | 103-107 °C |
Boiling Point: | 228.8 °C at 760 mmHg |
Flash Point: | 92.2 °C |
Appearance: | White crystalline powder |
Hazard Symbols: | Xi, Xn |
Risk Codes: | 36/37/38-20/21/22 |
Safety: | 26-36-36/37/39 |
Transport Information: | UN 3276 |
PSA: | 36.68000 |
LogP: | 1.71578 |
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The 3-Pyridinecarbonitrile,5-bromo-, with the CAS registry number 35590-37-5, is also known as 5-Bromonicotinonitrile. It belongs to the product categories of Blocks; Bromides; Carboxes; Pyridines; Pyridine; Organohalides; Nucleotides and Nucleosides; Bases & Related Reagents; Nucleotides; Boronic Acid; C6 Heterocyclic Building Blocks; Halogenated Heterocycles; Heterocyclic Building Blocks. This chemical's molecular formula is C6H3BrN2 and molecular weight is 183.00542. Its IUPAC name is called 5-bromopyridine-3-carbonitrile. What's more, the product should be sealed and stored in cool and dry place.
Physical properties of 3-Pyridinecarbonitrile,5-bromo-: (1)ACD/LogP: 1.24; (2)#H bond acceptors: 2; (3)Index of Refraction: 1.611; (4)Molar Refractivity: 36.83 cm3; (5)Molar Volume: 106 cm3; (6)Surface Tension: 63.7 dyne/cm; (7)Density: 1.72 g/cm3; (8)Flash Point: 92.2 °C; (9)Enthalpy of Vaporization: 46.54 kJ/mol; (10)Boiling Point: 228.8 °C at 760 mmHg; (11)Vapour Pressure: 0.0721 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes and may cause damage to health. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=C(C=NC=C1Br)C#N
(2)InChI: InChI=1S/C6H3BrN2/c7-6-1-5(2-8)3-9-4-6/h1,3-4H
(3)InChIKey: FTFFHWWIPOQCBC-UHFFFAOYSA-N