3-Chloroisoquinoline Chemical Properties

Melting point:

45-46 °C

Boiling point:

291.8±13.0 °C(Predicted)

Density 

1.270±0.06 g/cm3(Predicted)

storage temp. 

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

form 

Solid

pka

1.84±0.30(Predicted)

Appearance

White to light yellow Solid

InChI

InChI=1S/C9H6ClN/c10-9-5-7-3-1-2-4-8(7)6-11-9/h1-6H

InChIKey

CPCMFADZMOYDSZ-UHFFFAOYSA-N

SMILES

C1C2=C(C=CC=C2)C=C(Cl)N=1

Safety Information

Hazard Codes 

Xi

Hazard Note 

Irritant

HS Code 

2933399990

3-Chloroisoquinoline Usage And Synthesis

References

[1] Patent: WO2010/45401, 2010, A1. Location in patent: Page/Page column 88
[2] Patent: WO2010/45402, 2010, A1. Location in patent: Page/Page column 87
[3] Patent: US2005/113576, 2005, A1. Location in patent: Page/Page column 30
[4] Chemische Berichte, 1886, vol. 19, p. 1655,2356
[5] Chemische Berichte, 1886, vol. 19, p. 1655,2356

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