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CAS No.: | 3430-16-8 |
---|---|
Name: | 3-Bromo-5-methylpyridine |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C6H6BrN |
Molecular Weight: | 172.024 |
Synonyms: | 3-Picoline,5-bromo- (7CI,8CI);5-Bromo-3-methylpyridine;5-Bromo-3-picoline; |
EINECS: | 630-960-1 |
Density: | 1.494 g/cm3 |
Melting Point: | 16.5-16.7 °C |
Boiling Point: | 197.4 °C at 760 mmHg |
Flash Point: | 73.2 °C |
Appearance: | Light yellow liquid |
Hazard Symbols: | Xn, Xi |
Risk Codes: | 36/37/38-41-22 |
Safety: | 26-36/37/39-39 |
PSA: | 12.89000 |
LogP: | 2.15250 |
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The 5-Bromo-3-picoline is an organic compound with the formula C6H6BrN. The IUPAC name of this chemical is 3-bromo-5-methylpyridine. With the CAS registry number 3430-16-8, it is also named as Pyridine, 3-bromo-5-methyl-. The product's categories are Pyridine; Pyridines, Pyrimidines, Purines and Pteredines; Pyridines; Building Blocks; Halides; Boronic Acid; C5 Heterocyclic Building Blocks; Halogenated Heterocycles; Heterocyclic Building Blocks. Besides, it is light yellow liquid.
Physical properties about 5-Bromo-3-picoline are: (1)ACD/LogP: 2.21; (2)#H bond acceptors: 1; (3)Polar Surface Area: 12.89 Å2; (4)Index of Refraction: 1.553; (5)Molar Refractivity: 36.85 cm3; (6)Molar Volume: 115.1 cm3; (7)Polarizability: 14.61×10-24cm3; (8)Surface Tension: 40 dyne/cm; (9)Density: 1.494 g/cm3; (10)Flash Point: 73.2 °C; (11)Enthalpy of Vaporization: 41.59 kJ/mol; (12)Boiling Point: 197.4 °C at 760 mmHg; (13)Vapour Pressure: 0.533 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
It is harmful if swallowed and risk of serious damage to eyes. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides, this chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cc(cnc1)C
(2)InChI: InChI=1/C6H6BrN/c1-5-2-6(7)4-8-3-5/h2-4H,1H3
(3)InChIKey: ADCLTLQMVAEBLB-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C6H6BrN/c1-5-2-6(7)4-8-3-5/h2-4H,1H3
(5)Std. InChIKey: ADCLTLQMVAEBLB-UHFFFAOYSA-N