85559-46-2

Name 4-(1-AZI-2,2,2-TRIFLUOROETHYL)BENZOIC ACID
CAS 85559-46-2
Molecular Formula C9H5F3N2O2
MDL Number MFCD00236809
Molecular Weight 230.14
MOL File 85559-46-2.mol
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Chemical Properties

Appearance White Solid
Melting point  110-112°C
Boiling point  298.6±50.0 °C(Predicted)
density  1.59±0.1 g/cm3 (20 ºC 760 Torr)
storage temp.  2-8°C
solubility  Chloroform (Slightly), Methanol (Slightly)
form  Solid
pka 4.15±0.10(Predicted)
color  White to Pale Beige
Major Application peptide synthesis
InChI InChI=1S/C9H5F3N2O2/c10-9(11,12)8(13-14-8)6-3-1-5(2-4-6)7(15)16/h1-4H,(H,15,16)
InChIKey CZPAJVBVULSLGG-UHFFFAOYSA-N
SMILES C(O)(=O)C1=CC=C(C2(C(F)(F)F)N=N2)C=C1

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319
Precautionary statements  P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
WGK Germany  WGK 3
HS Code  2933.99.8290
Storage Class 11 - Combustible Solids

Hazard Information

Spectrum Detail

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