5-Chlorobenzotriazole  Structure

5-Chlorobenzotriazole

Chemical Properties

Melting point 157-159 °C (lit.)
Boiling point 252.42°C (rough estimate)
Density  1.3647 (rough estimate)
refractive index  1.7200 (estimate)
storage temp.  2-8°C, protect from light
solubility  DMSO (Slightly), Methanol (Slightly)
pka 7.46±0.40(Predicted)
form  powder to crystal
color  White to Orange to Green
Water Solubility  SOLUBLE IN HOT WATER
InChI InChI=1S/C6H4ClN3/c7-4-1-2-5-6(3-4)9-10-8-5/h1-3H,(H,8,9,10)
InChIKey PZBQVZFITSVHAW-UHFFFAOYSA-N
SMILES N1C2=CC(Cl)=CC=C2N=N1
CAS DataBase Reference 94-97-3(CAS DataBase Reference)
FDA UNII 8C7O46G78K
EPA Substance Registry System 1H-Benzotriazole, 5-chloro- (94-97-3)
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H302
Precautionary statements P264-P270-P301+P312-P330-P501
Hazard Codes  Xn,Xi
Risk Statements  22-37
Safety Statements  24/25
WGK Germany  3
TSCA  TSCA listed
HS Code  29339900
Storage Class 11 - Combustible Solids
NFPA 704:
0
2 0

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