Home Categories 3-(Cyanomethyl)benzoic acid
BD8956831

3-(Cyanomethyl)benzoic acid , 97% , 5689-33-8

CAS NO.:5689-33-8

Empirical Formula: C9H7NO2

Molecular Weight: 161.16

MDL number: MFCD08234486

Pack Size Price Stock Quantity
250mg RMB82.40 In Stock
1g RMB211.20 In Stock
5g RMB1000.00 In Stock
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Update time: 2022-07-08

PRODUCT Properties

Melting point: 175-176℃ (ethanol, 25% )
Boiling point: 371.6±25.0 °C(Predicted)
Density  1.257±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,Room Temperature
solubility  DMSO, Methanol (Slightly)
pka 4.04±0.10(Predicted)
form  Solid
color  White
Major Application pharmaceutical small molecule
InChI 1S/C9H7NO2/c10-5-4-7-2-1-3-8(6-7)9(11)12/h1-3,6H,4H2,(H,11,12)
InChIKey DATIHVJZEPOWPT-UHFFFAOYSA-N
SMILES N#CCc1cc(ccc1)C(=O)O

Description and Uses

3-(Cyanomethyl)benzoic Acid (Ketoprofen EP Impurity H) is a reagent used in the synthesis of various pharmaceutically important compounds, such as its use in the synthesis of neprilysin inhibitors.

Safety

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338
WGK Germany  WGK 3
HS Code  2926907090
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2

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