4-BENZYLOXYPHENYLACETIC ACID
- Product Name4-BENZYLOXYPHENYLACETIC ACID
- CAS6547-53-1
- MFC15H14O3
- MW242.27
- EINECS229-463-9
- MOL File6547-53-1.mol
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) |
NIST Chemistry Reference | 4-Benzyloxyphenyl acetic acid(6547-53-1) |
Safety Information
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 |