3,5-DIMETHOXYCINNAMIC ACID Structure

3,5-DIMETHOXYCINNAMIC ACID

Chemical Properties

Melting point 174-175 °C(lit.)
Boiling point 267.4°C (rough estimate)
Density  1.0627 (rough estimate)
refractive index  1.4389 (estimate)
storage temp.  Sealed in dry,Room Temperature
pka 4.33±0.10(Predicted)
form  solid
Appearance Off-white to light brown Solid
Water Solubility  31.44mg/L(25 ºC)
InChI 1S/C11H12O4/c1-14-9-5-8(3-4-11(12)13)6-10(7-9)15-2/h3-7H,1-2H3,(H,12,13)/b4-3+
InChIKey VLSRUFWCGBMYDJ-ONEGZZNKSA-N
SMILES COc1cc(OC)cc(\C=C\C(O)=O)c1
CAS DataBase Reference 16909-11-8(CAS DataBase Reference)
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) GHS hazard pictograms
Signal wordWarning
Hazard statements H319-H335-H315
Precautionary statements P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  37/39-26-24/25
WGK Germany  3
HS Code  29163990
Storage Class 11 - Combustible Solids
NFPA 704:
0
2 0

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