99469-99-5

Name 3-Ethoxy-4-ethoxycarbonyl phenylacetic acid
CAS 99469-99-5
EINECS(EC#) 427-630-2
Molecular Formula C13H16O5
MDL Number MFCD08704233
Molecular Weight 252.26
MOL File 99469-99-5.mol
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Chemical Properties

Appearance White to Pale Yellow Solid
Melting point  78-80°C
Boiling point  414.8±35.0 °C(Predicted)
density  1.191
storage temp.  Sealed in dry,Room Temperature
solubility  Chloroform (Slightly), Methanol (Slightly)
form  neat
pka 3.96±0.10(Predicted)
color  White to Off-White
Usage Repaglinide intermediate
Major Application pharmaceutical (small molecule)
InChI InChI=1S/C13H16O5/c1-3-17-11-7-9(8-12(14)15)5-6-10(11)13(16)18-4-2/h5-7H,3-4,8H2,1-2H3,(H,14,15)
InChIKey OTGSESBEJUHCES-UHFFFAOYSA-N
SMILES C1(CC(O)=O)=CC=C(C(OCC)=O)C(OCC)=C1
CAS DataBase Reference 99469-99-5(CAS DataBase Reference)

Safety Data

Hazard Codes  Xi
Risk Statements 
Safety Statements 
RIDADR  UN3261
WGK Germany  WGK 3
REACH Registrations Active
HazardClass  8
HS Code  2918992090
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Dam. 1

Hazard Information

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