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Carprofen Structure

Carprofen

Chemical Properties

Melting point 186-1880C
Boiling point 509.1±35.0 °C(Predicted)
Density  1.2011 (rough estimate)
refractive index  1.5200 (estimate)
storage temp.  Sealed in dry,2-8°C
solubility  DMSO: soluble20mg/mL, clear
form  powder
pka 4.84±0.30(Predicted)
color  white to beige
Merck  14,1862
InChI InChI=1S/C15H12ClNO2/c1-8(15(18)19)9-2-4-11-12-7-10(16)3-5-13(12)17-14(11)6-9/h2-8,17H,1H3,(H,18,19)
InChIKey PUXBGTOOZJQSKH-UHFFFAOYSA-N
SMILES N1C2=C(C=C(Cl)C=C2)C2=C1C=C(C(C)C(O)=O)C=C2
CAS DataBase Reference 53716-49-7(CAS DataBase Reference)
FDA UNII FFL0D546HO
EPA Substance Registry System 9H-Carbazole-2-acetic acid, 6-chloro-.alpha.-methyl- (53716-49-7)

Safety

Symbol(GHS)
Signal wordDanger
Hazard statements H301
Precautionary statements P301+P330+P331+P310
Hazard Codes  T,Xn
Risk Statements  25-36/37/38-20/21/22
Safety Statements  45-36-26
RIDADR  UN 2811
WGK Germany  3
RTECS  FE3180000
HazardClass  6.1
PackingGroup  III
HS Code  29339900
Toxicity LD50 orally in mice: 400 mg/kg (Berger, Corraz)
NFPA 704:
0
2 0

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