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3-(CYANOMETHYL)BENZOIC ACID

Product Name
3-(CYANOMETHYL)BENZOIC ACID
CAS No.
5689-33-8
Chemical Name
3-(CYANOMETHYL)BENZOIC ACID
Synonyms
25-50 g;Ketoprofen EP impurity 1;Ketoprofen EP Impurity H;m-(Cyanomethyl)benzoic acid;3-Carboxyphenylacetonitrile;3-(CYANOMETHYL)BENZOIC ACID;Benzoic acid, 3-(cyanomethyl)-;Ketoprofen Impurity 8(Ketoprofen EP Impurity H);3-(Cyanomethyl)benzoic acidQ: What is 3-(Cyanomethyl)benzoic acid Q: What is the CAS Number of 3-(Cyanomethyl)benzoic acid Q: What is the storage condition of 3-(Cyanomethyl)benzoic acid Q: What are the applications of 3-(Cyanomethyl)benzoic acid
CBNumber
CB2282116
Molecular Formula
C9H7NO2
Formula Weight
161.16
MOL File
5689-33-8.mol
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3-(CYANOMETHYL)BENZOIC ACID Property

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
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Safety

HS Code 
2926907090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H302Harmful if swallowed

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

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N-Bromosuccinimide Price

TRC
Product number
C981890
Product name
3-(Cyanomethyl)benzoicAcid
Packaging
250mg
Price
$135
Updated
2021/12/16
TRC
Product number
C981890
Product name
3-(Cyanomethyl)benzoicAcid
Packaging
1g
Price
$215
Updated
2021/12/16
TRC
Product number
C981890
Product name
3-(Cyanomethyl)benzoicAcid
Packaging
5g
Price
$520
Updated
2021/12/16
Biosynth Carbosynth
Product number
FC67887
Product name
3-(Cyanomethyl)benzoic acid
Packaging
5G
Price
$75
Updated
2021/12/16
Biosynth Carbosynth
Product number
FC67887
Product name
3-(Cyanomethyl)benzoic acid
Packaging
10g
Price
$125
Updated
2021/12/16
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3-(CYANOMETHYL)BENZOIC ACID Chemical Properties,Usage,Production

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.

Uses

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

Synthesis

68432-92-8

5689-33-8

Lithium hydroxide (493 mg, 11.7 mmol) was added to a stirred mixed solution of methyl 3-(cyanomethyl)benzoate (1.029 g, 5.87 mmol) in THF (10 ml) and water (0.5 ml) at room temperature. The reaction mixture was stirred continuously at 50 °C overnight. After completion of the reaction, the solvent was removed by evaporation and the residue was partitioned between water and ether. The aqueous phase was extracted three times with ether. Subsequently, the aqueous phase was acidified to acidity with concentrated hydrochloric acid and again extracted three times with ether. All organic phases were combined, dried over anhydrous sodium sulfate and concentrated under reduced pressure to give 745 mg (79% yield) of 3-cyanomethylbenzoic acid. The product was characterized by 1H NMR (DMSO-D6): δ 13.11 (1H, s), 7.95 (1H, s), 7.90 (1H, d, J = 7.6 Hz), 7.60 (1H, m), 7.53 (1H, t, J = 7.6 Hz), 4.14 (2H, s); MS (ESI) m/z 160 (M-1).

References

[1] Patent: WO2004/96781, 2004, A1. Location in patent: Page 80

3-(CYANOMETHYL)BENZOIC ACID Preparation Products And Raw materials

Raw materials

Preparation Products

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3-(CYANOMETHYL)BENZOIC ACID Suppliers

J & K SCIENTIFIC LTD.
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18210857532; 18210857532
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jkinfo@jkchemical.com
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China
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+86 (0) 571 85 58 67 18
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Bide Pharmatech Ltd.
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400-164-7117 13681763483
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+86-21-61629029
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View Lastest Price from 3-(CYANOMETHYL)BENZOIC ACID manufacturers

Career Henan Chemical Co
Product
3-(CYANOMETHYL)BENZOIC ACID 5689-33-8
Price
US $1.00/KG
Min. Order
1KG
Purity
99%
Supply Ability
200kg
Release date
2019-12-24

5689-33-8, 3-(CYANOMETHYL)BENZOIC ACIDRelated Search:


  • 3-(CYANOMETHYL)BENZOIC ACID
  • 25-50 g
  • 3-Carboxyphenylacetonitrile
  • m-(Cyanomethyl)benzoic acid
  • Ketoprofen EP Impurity H
  • Ketoprofen Impurity 8(Ketoprofen EP Impurity H)
  • Benzoic acid, 3-(cyanomethyl)-
  • 3-(Cyanomethyl)benzoic acidQ: What is 3-(Cyanomethyl)benzoic acid Q: What is the CAS Number of 3-(Cyanomethyl)benzoic acid Q: What is the storage condition of 3-(Cyanomethyl)benzoic acid Q: What are the applications of 3-(Cyanomethyl)benzoic acid
  • Ketoprofen EP impurity 1
  • 5689-33-8