400-76-0

Name 4-Amino-3-(Trifluoromethyl)Benzoic Acid 3-Trifluoromethyl-4-Aminobenzoic Acid
CAS 400-76-0
EINECS(EC#) 630-042-0
Molecular Formula C8H6F3NO2
MDL Number MFCD03407960
Molecular Weight 205.13
MOL File 400-76-0.mol
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Chemical Properties

Melting point  204-206°C
Boiling point  319.1±42.0 °C(Predicted)
density  1.489
storage temp.  Refrigerator
solubility  DMSO, Methaniol
form  Solid
pka 4.43±0.10(Predicted)
color  Off-White to Pale Yellow
Sensitive  Air Sensitive
InChI InChI=1S/C8H6F3NO2/c9-8(10,11)5-3-4(7(13)14)1-2-6(5)12/h1-3H,12H2,(H,13,14)
InChIKey NPPPORJZPNJXNQ-UHFFFAOYSA-N
SMILES C(O)(=O)C1=CC=C(N)C(C(F)(F)F)=C1

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Hazard Codes  Xi
HazardClass  IRRITANT
HS Code  2922290090

Hazard Information

Spectrum Detail

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