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4-BENZYLOXYPHENYLACETIC ACID Structure

4-BENZYLOXYPHENYLACETIC ACID

Chemical Properties

Melting point 119-123 °C (lit.)
Boiling point 418.8±25.0 °C(Predicted)
Density  1.201±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,Room Temperature
pka 4.44±0.10(Predicted)
form  Crystalline Powder
color  White
Water Solubility  89.9mg/L(25 ºC)
InChI InChI=1S/C15H14O3/c16-15(17)10-12-6-8-14(9-7-12)18-11-13-4-2-1-3-5-13/h1-9H,10-11H2,(H,16,17)
InChIKey XJHGAJLIKDAOPE-UHFFFAOYSA-N
SMILES C1(CC(O)=O)=CC=C(OCC2=CC=CC=C2)C=C1
CAS DataBase Reference 6547-53-1(CAS DataBase Reference)
FDA UNII BE5NH2G3DW
NIST Chemistry Reference 4-Benzyloxyphenyl acetic acid(6547-53-1)

Safety

Symbol(GHS) GHS hazard pictograms
Signal wordWarning
Hazard statements H315-H319
Precautionary statements P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Hazard Codes  Xi,Xn
Risk Statements  20/21/22-36/37/38
Safety Statements  26-36-24/25
WGK Germany  3
Hazard Note  Irritant
HS Code  29189900
NFPA 704:
1
2 0

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