ALPHA-CYANO-4-HYDROXYCINNAMIC ACID Structure

ALPHA-CYANO-4-HYDROXYCINNAMIC ACID

Chemical Properties

Melting point 245-250 °C(lit.)
Boiling point 324.41°C (rough estimate)
Density  1.3175 (rough estimate)
refractive index  1.5400 (estimate)
storage temp.  2-8°C
solubility  methanol: 10 mg/mL, clear
form  powder
pka 0.85±0.10(Predicted)
color  yellow
Water Solubility  H2O: slightly soluble
methanol: water: soluble
polar organic solvents: soluble
BRN  3271427
InChI InChI=1S/C10H7NO3/c11-6-8(10(13)14)5-7-1-3-9(12)4-2-7/h1-5,12H,(H,13,14)
InChIKey AFVLVVWMAFSXCK-VMPITWQZSA-N
SMILES C(O)(=O)C(C#N)=CC1=CC=C(O)C=C1
CAS DataBase Reference 28166-41-8(CAS DataBase Reference)
FDA UNII NL5EEM9E2G
Absorption ≥2000 at 337nm (mol. absorption)
UNSPSC Code 41116105
NACRES NA.77

Safety

Symbol(GHS) GHS hazard pictograms
Signal wordWarning
Hazard statements H315-H317-H319-H335
Precautionary statements P280-P302+P352-P305+P351+P338
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
WGK Germany  3
10-23
HS Code  29269090
Storage Class 11 - Combustible Solids
Hazard Classifications Skin Sens. 1B
NFPA 704:
0
2 0

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ALPHA-CYANO-4-HYDROXYCINNAMIC ACID Chemical Properties,Usage,Production

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