117391-57-8

Name 3-AMINO-3-(3,4-DICHLORO-PHENYL)-PROPIONIC ACID
CAS 117391-57-8
Molecular Formula C9H9Cl2NO2
MDL Number MFCD00462884
Molecular Weight 234.08
MOL File 117391-57-8.mol
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Chemical Properties

Melting point  224-226°C
Boiling point  371.9±42.0 °C(Predicted)
density  1.447±0.06 g/cm3(Predicted)
storage temp.  Store at Room Tem.
form  solid
pka 3.54±0.10(Predicted)
InChI 1S/C9H9Cl2NO2/c10-6-2-1-5(3-7(6)11)8(12)4-9(13)14/h1-3,8H,4,12H2,(H,13,14)
InChIKey ACJWNKAQMZQVBW-UHFFFAOYSA-N
SMILES NC(CC(O)=O)C(C=C1)=CC(Cl)=C1Cl
CAS DataBase Reference 117391-57-8(CAS DataBase Reference)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338
Hazard Codes  Xn
Risk Statements 
WGK Germany  WGK 3
HazardClass  IRRITANT
HS Code  2922498590
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

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