3-(4-HYDROXYPHENYL)PROPIONITRILE Chemical Properties

Melting point:

56-58°C

Boiling point:

166°C 8mm

Density 

1.127±0.06 g/cm3(Predicted)

Flash point:

166°C/8mm

storage temp. 

2-8°C

solubility 

Chloroform (Sparingly), Methanol (Slightly)

form 

Solid

pka

9.88±0.15(Predicted)

color 

White to Pale Yellow

Water Solubility 

Insoluble in water.

BRN 

1448680

InChI

InChI=1S/C9H9NO/c10-7-1-2-8-3-5-9(11)6-4-8/h3-6,11H,1-2H2

InChIKey

KDMJGLYRWRHKJS-UHFFFAOYSA-N

SMILES

C1(CCC#N)=CC=C(O)C=C1

CAS DataBase Reference

17362-17-3(CAS DataBase Reference)

NIST Chemistry Reference

3-(4-Hydroxyphenyl)propionitrile(17362-17-3)

Safety Information

Hazard Codes 

Xi

Risk Statements 

20/21/22-36/37/38

Safety Statements 

26-36/37/39

RIDADR 

3276

HazardClass 

6.1

PackingGroup 

III

HS Code 

2926907090

MSDS

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3-(4-HYDROXYPHENYL)PROPIONITRILE Usage And Synthesis

Uses

3-(4-Hydroxyphenyl)propionitrile is commonly used as a tool to evaluate the biological role of ERβ.

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