330645-87-9

Name 5-Chloro-1-[bis(dimethylamino)methylene]-1H-benzotriazolium 3-oxide hexafluorophosphate
CAS 330645-87-9
EINECS(EC#) 608-825-3
Molecular Formula C11H15ClF6N5OP
MDL Number MFCD04973268
Molecular Weight 413.69
MOL File 330645-87-9.mol

Chemical Properties

Melting point  185-190 °C
storage temp.  Store at 0-5°C
solubility  soluble in Dimethylformamide
form  powder to crystal
color  White to Almost white
Detection Methods HPLC,NMR
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 Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H317
Precautionary statements  P261-P272-P280-P302+P352-P333+P313-P362+P364
Hazard Codes  Xi,Xn
Risk Statements 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
WGK Germany  3
F  10
HS Code  29339900
Storage Class 11 - Combustible Solids
Hazard Classifications Skin Sens. 1A

Hazard Information

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