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)
form  Solid
pka 4.04±0.10(Predicted)
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)  Exclamation Mark (GHS07)
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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