2-Butyl-1H-imidazole-4-carbaldehyde Chemical Properties

Melting point:

117-120°C

Boiling point:

359.1±15.0 °C(Predicted)

Density 

1.099±0.06 g/cm3(Predicted)

storage temp. 

under inert gas (nitrogen or Argon) at 2-8°C

solubility 

soluble in Methanol

form 

powder to crystal

pka

11.58±0.10(Predicted)

color 

White to Light yellow

InChI

InChI=1S/C8H12N2O/c1-2-3-4-8-9-5-7(6-11)10-8/h5-6H,2-4H2,1H3,(H,9,10)

InChIKey

PTHGVOCFAZSNNA-UHFFFAOYSA-N

SMILES

C1(CCCC)NC(C=O)=CN=1

CAS DataBase Reference

68282-49-5(CAS DataBase Reference)

Safety Information

Hazard Codes 

Xi

Risk Statements 

36/37/38-43

Safety Statements 

26-37/39-36/37

Hazard Note 

Irritant

HS Code 

2933998090

2-Butyl-1H-imidazole-4-carbaldehyde Usage And Synthesis

Description

2-Butyl-1H-imidazole-4-carbaldehyde appears as a colourless to pale yellow liquid with a strong, pungent odour. The basic structure of 2-Butyl-1H-imidazole-4-carbaldehyde consists of a butyl group attached to an imidazole ring, with a carbaldehyde functional group. This compound is soluble in organic solvents but insoluble in water.

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