3-Amino-5-bromobenzotrifluoride Structure

3-Amino-5-bromobenzotrifluoride

Chemical Properties

Boiling point 220-223 °C (lit.)
Density  1.697 g/mL at 25 °C (lit.)
refractive index  n20/D 1.528(lit.)
Flash point >230 °F
storage temp.  Keep in dark place,Inert atmosphere,Room temperature
solubility  Chloroform (Slightly), Methanol (Slightly)
pka 2.30±0.10(Predicted)
form  Liquid
color  Colorless to yellow
InChI InChI=1S/C7H5BrF3N/c8-5-1-4(7(9,10)11)2-6(12)3-5/h1-3H,12H2
InChIKey HJTLKVYOWNTDPF-UHFFFAOYSA-N
SMILES C1(N)=CC(C(F)(F)F)=CC(Br)=C1
CAS DataBase Reference 54962-75-3(CAS DataBase Reference)
FDA UNII 7LQ4G2QG6G
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P261-P264-P271-P280-P302+P352-P305+P351+P338
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
WGK Germany  3
Hazard Note  Irritant
HazardClass  6.1
HS Code  29214300
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
NFPA 704:
0
2 0

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