ClotriMazole IMpurity A Structure

ClotriMazole IMpurity A

Chemical Properties

Melting point 138-140°C
Boiling point 475.9±40.0 °C(Predicted)
Density  1.13±0.1 g/cm3(Predicted)
storage temp.  -20°C Freezer
solubility  Chloroform (Slightly), DMSO (Slightly), Ethanol (Slightly), Methanol (Slightly)
pka 6.28±0.30(Predicted)
form  Solid
color  White to Off-White
Major Application pharmaceutical
InChI 1S/C22H17ClN2/c23-21-13-11-20(12-14-21)22(25-16-15-24-17-25,18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-17H
InChIKey BLNLHAFFGFCSRK-UHFFFAOYSA-N
SMILES Clc1ccc(cc1)C([n]4cncc4)(c3ccccc3)c2ccccc2
FDA UNII ZWC2DU38NE
UNSPSC Code 41116107
NACRES NA.24

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H302-H315-H319-H335
Precautionary statements P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
WGK Germany  WGK 3
Storage Class 13 - Non Combustible Solids
Hazard Classifications Aquatic Chronic 4

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