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331-39-5

Name Caffeic acid
CAS 331-39-5
EINECS(EC#) 206-361-2
Molecular Formula C9H8O4
MDL Number MFCD00004392
Molecular Weight 180.16
MOL File 331-39-5.mol

Chemical Properties

Appearance Light yellow to greenish-yellow powder
Melting point  211-213 °C (dec.) (lit.)
Boiling point  272.96°C (rough estimate)
density  1.2933 (rough estimate)
refractive index  1.4500 (estimate)
storage temp.  Store at RT.
solubility  ethanol: 50 mg/mL
form  powder
pka 4.58±0.10(Predicted)
color  yellow to tan
Stability: Stable. Combustible. Incompatible with strong oxidizing agents, strong bases.
Water Solubility  soluble in hot water
Merck  14,1635
BRN  2210883
InChIKey QAIPRVGONGVQAS-DUXPYHPUSA-N
LogP 1.150
CAS DataBase Reference 331-39-5(CAS DataBase Reference)
IARC 2B (Vol. 56) 1993
NIST Chemistry Reference Cinnamic acid, 3,4-dihydroxy-(331-39-5)
EPA Substance Registry System 331-39-5(EPA Substance)

Safety Data

Hazard Codes  Xn,Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
R40:Limited evidence of a carcinogenic effect.
R63:Possible risk of harm to the unborn child.
R68:Possible risk of irreversible effects.
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S36:Wear suitable protective clothing .
WGK Germany  3
RTECS  GD8950000
Hazard Note  Irritant
HS Code  29182990
Hazardous Substances Data 331-39-5(Hazardous Substances Data)

Hazard Information

Material Safety Data Sheet(MSDS)

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