5-Bromopyridine-2-carbaldehyde supplier

Name
5-Bromopyridine-2-carbaldehyde
EINECS -0
CAS No. 31181-90-5
Article Data57
CAS DataBase
Density 1.683 g/cm³
Solubility Insoluble in water.
Melting Point 93 °C
Formula C₆H₄BrNO
Boiling Point 237.707 °C at 760 mmHg
Molecular Weight 186.008
Flash Point 97.562 °C
Transport Information
Appearance Light yellow Cryst
Safety 22-26-36/37/39-36
Risk Codes Xi:;
Molecular Structure
Hazard Symbols 36/37/38-20/21/22:;
Synonyms Picolinaldehyde,5-bromo- (8CI);5-Bromo-2-formylpyridine;5-Bromo-2-pyridinaldehyde;5-Bromo-2-pyridinecarbaldehyde;5-Bromo-2-pyridinecarboxaldehyde;
PSA 29.96000
LogP 1.65660

5-Bromopyridine-2-carbaldehyde Specification

The 5-Bromopyridine-2-carbaldehyde, with CAS registry number 31181-90-5, belongs to the following product categories: (1)Aldehydes; (2)Blocks; (3)Bromides; (4)Pyridines; (5)Pyridine; (6)Carbonyl Compounds; (7)Heterocycles; (8)Pharmacetical; (9)Aldehyde; (10)Building Blocks. It has the systematic name of 5-bromopyridine-2-carbaldehyde. This chemical is a kind of light yellow cryst.

Physical properties of 5-Bromopyridine-2-carbaldehyde: (1)ACD/LogP: 1.35; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 6; (6)ACD/BCF (pH 7.4): 6; (7)ACD/KOC (pH 5.5): 129; (8)ACD/KOC (pH 7.4): 129; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 29.96 Å²; (13)Index of Refraction: 1.619; (14)Molar Refractivity: 38.787 cm³; (15)Molar Volume: 110.508 cm³; (16)Polarizability: 15.376×10^-24cm³; (17)Surface Tension: 52.157 dyne/cm; (18)Enthalpy of Vaporization: 47.454 kJ/mol; (19)Vapour Pressure: 0.044 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The 5-Bromopyridine-2-carbaldehyde irritates to eyes, respiratory system and skin. And this chemical is harmful by inhalation, in contact with skin and if swallowed. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(ncc1Br)C=O
(2)InChI: InChI=1/C6H4BrNO/c7-5-1-2-6(4-9)8-3-5/h1-4H
(3)InChIKey: ZQVLPMNLLKGGIU-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C6H4BrNO/c7-5-1-2-6(4-9)8-3-5/h1-4H
(5)Std. InChIKey: ZQVLPMNLLKGGIU-UHFFFAOYSA-N

Product Name

5-Bromopyridine-2-carbaldehyde

5-Bromopyridine-2-carbaldehyde Specification

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