1-[2-(4-Chlorophenyl)-1-(1-hydroxy-1-phenylethyl)ethyl]-1,2,4-triazole Structure

1-[2-(4-Chlorophenyl)-1-(1-hydroxy-1-phenylethyl)ethyl]-1,2,4-triazole

Chemical Properties

Boiling point 533.1±60.0 °C(Predicted)
Density  1.22
storage temp.  Store at -20°C
solubility  DMF: 100 mg/ml; DMF:PBS(pH 7.2)(1:1): 0.5 mg/ml; DMSO: 50 mg/ml; Ethanol: 25 mg/ml
form  powder to crystal
pka 13.11±0.29(Predicted)
color  White to Yellow to Orange
InChI InChI=1S/C18H18ClN3O/c1-18(23,15-5-3-2-4-6-15)17(22-13-20-12-21-22)11-14-7-9-16(19)10-8-14/h2-10,12-13,17,23H,11H2,1H3
InChIKey YULDTPKHZNKFEY-UHFFFAOYSA-N
SMILES C(CC1C=CC(=CC=1)Cl)(C(C)(O)C1C=CC=CC=1)N1C=NC=N1
CAS DataBase Reference 224047-41-0
FDA UNII N9XRW3TF90

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319
Precautionary statements P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Safety Statements  24/25
HS Code  29339900
NFPA 704:
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1-[2-(4-Chlorophenyl)-1-(1-hydroxy-1-phenylethyl)ethyl]-1,2,4-triazole Chemical Properties,Usage,Production

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1-[2-(4-Chlorophenyl)-1-(1-hydroxy-1-phenylethyl)ethyl]-1,2,4-triazole Spectrum

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