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4'-Hydroxy-4-biphenylcarbonitrile Structure

4'-Hydroxy-4-biphenylcarbonitrile

Chemical Properties

Melting point 191-195 °C (lit.)
Boiling point 331.88°C (rough estimate)
Density  1.1266 (rough estimate)
vapor pressure  0.022 hPa (20 °C)
refractive index  1.6060 (estimate)
storage temp.  Inert atmosphere,Room Temperature
solubility  12.7g/l no data available
form  Crystalline Powder
pka 9.43±0.26(Predicted)
color  Light yellow to beige
InChI InChI=1S/C13H9NO/c14-9-10-1-3-11(4-2-10)12-5-7-13(15)8-6-12/h1-8,15H
InChIKey MDKUGDVEJBGKLD-UHFFFAOYSA-N
SMILES C1(C2=CC=C(O)C=C2)=CC=C(C#N)C=C1
CAS DataBase Reference 19812-93-2(CAS DataBase Reference)
NIST Chemistry Reference 4-Cyano-4'-hydroxybiphenyl(19812-93-2)

Safety

Symbol(GHS)
Signal wordWarning
Hazard statements H317-H411
Precautionary statements P261-P272-P273-P280-P302+P352-P333+P313
Hazard Codes  Xn
Risk Statements  36/37/38-20/21/22
Safety Statements  36/37/39-26-22-36/37-9-36
RIDADR  3439
WGK Germany  3
HS Code  2926 90 70
HazardClass  6.1
PackingGroup  III
Toxicity LD50 orally in Rabbit: > 5000 mg/kg
NFPA 704:
1
2 0

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