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5-Chloro-1-[bis(dimethylamino)methylene]-1H-benzotriazolium 3-oxide hexafluorophosphate Structure

5-Chloro-1-[bis(dimethylamino)methylene]-1H-benzotriazolium 3-oxide hexafluorophosphate

Chemical Properties

Melting point 185-190 °C
storage temp.  Store at +2°C to +8°C.
solubility  soluble in Dimethylformamide
form  powder to crystal
color  White to Almost white
Major Application peptide synthesis
InChI InChI=1S/C11H15ClN5O.F6P/c1-14(2)11(15(3)4)16-9-6-5-8(12)7-10(9)17(18)13-16;1-7(2,3,4,5)6/h5-7H,1-4H3;/q+1;-1
InChIKey ZHHGTMQHUWDEJF-UHFFFAOYSA-N
SMILES [P+5]([F-])([F-])([F-])([F-])([F-])[F-].C(=[N+]1/N=N(=O)C2=CC(Cl)=CC=C/12)(\N(C)C)/N(C)C
CAS DataBase Reference 330645-87-9(CAS DataBase Reference)

Safety Information

Hazard Codes  Xi,Xn
Risk Statements  20/21/22-36/37/38
Safety Statements  26-36-24/25
WGK Germany  3
F  10
HS Code  29339990
Storage Class 11 - Combustible Solids
Hazard Classifications Skin Sens. 1A

MSDS

Usage And Synthesis

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