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3,4-Dihydroxyphenylacetic acid Structure

3,4-Dihydroxyphenylacetic acid

Chemical Properties

Melting point 127-130 °C (lit.)
Boiling point 257.07°C (rough estimate)
Density  1.3037 (rough estimate)
refractive index  1.5090 (estimate)
storage temp.  Inert atmosphere,Room Temperature
solubility  water: soluble50mg/mL, clear, almost colorless
pka 4.42±0.10(Predicted)
form  Powder, Crystals or Lumps
color  White to off-white
Water Solubility  Soluble in water and methanol.
BRN  2211017
InChI InChI=1S/C8H8O4/c9-6-2-1-5(3-7(6)10)4-8(11)12/h1-3,9-10H,4H2,(H,11,12)
InChIKey CFFZDZCDUFSOFZ-UHFFFAOYSA-N
SMILES C1(CC(O)=O)=CC=C(O)C(O)=C1
LogP 0.980
CAS DataBase Reference 102-32-9(CAS DataBase Reference)
NIST Chemistry Reference Acetic acid, (3,4-dihydroxyphenyl)-,(102-32-9)
EPA Substance Registry System 3,4-Dihydroxyphenylacetic acid (102-32-9)

Safety Information

Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
WGK Germany  3
RTECS  AH0590000
10-23
HS Code  29182900

MSDS

Usage And Synthesis

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