ChemicalBook > CAS DataBase List > 4-(MORPHOLINOMETHYL)BENZONITRILE

4-(MORPHOLINOMETHYL)BENZONITRILE

Product Name
4-(MORPHOLINOMETHYL)BENZONITRILE
CAS No.
37812-51-4
Chemical Name
4-(MORPHOLINOMETHYL)BENZONITRILE
Synonyms
USAF A-3730;BUTTPARK 98\57-96;4-(Morpholinomethyl);N-(4-CYANOBENZYL)MORPHOLINE;4-(MORPHOLINOMETHYL)BENZONITRILE;4-MORPHOLIN-4-YLMETHYLBENZONITRILE;alpha-(4-morpholinyl)-p-tolunitril;4-(4-MORPHOLINYLMETHYL)BENZONITRILE;4-(4-morpholinylmethyl)-benzonitril;alpha-(4-morpholinyl)-p-tolunitrile
CBNumber
CB0217000
Molecular Formula
C12H14N2O
Formula Weight
202.25
MOL File
37812-51-4.mol
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4-(MORPHOLINOMETHYL)BENZONITRILE Property

Melting point:
84-89°C
Boiling point:
332.4±32.0 °C(Predicted)
Density 
1.14±0.1 g/cm3(Predicted)
storage temp. 
Sealed in dry,Room Temperature
pka
5.94±0.10(Predicted)
form 
Crystalline Powder
color 
White to light yellow
CAS DataBase Reference
37812-51-4
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Safety

HazardClass 
IRRITANT
HS Code 
29349990
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Danger
Hazard statements

H301Toxic if swalloed

H314Causes severe skin burns and eye damage

H318Causes serious eye damage

Precautionary statements

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

P280Wear protective gloves/protective clothing/eye protection/face protection.

P301+P310IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.

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

P310Immediately call a POISON CENTER or doctor/physician.

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N-Bromosuccinimide Price

Sigma-Aldrich
Product number
OTV000427
Product name
4-(Morpholinomethyl)benzonitrile
Packaging
250 mg
Price
$107
Updated
2025/07/31
TRC
Product number
M725318
Product name
4-(Morpholinomethyl)benzonitrile
Packaging
25mg
Price
$45
Updated
2021/12/16
SynQuest Laboratories
Product number
4H37-1-2K
Product name
4-(Morpholinomethyl)benzonitrile
Packaging
1g
Price
$80
Updated
2021/12/16
AK Scientific
Product number
Z4676
Product name
4-(Morpholinomethyl)benzonitrile
Packaging
1g
Price
$93
Updated
2021/12/16
ChemScene
Product number
CS-0093031
Product name
4-(Morpholinomethyl)benzonitrile
Packaging
5g
Price
$95
Updated
2021/12/16
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4-(MORPHOLINOMETHYL)BENZONITRILE Chemical Properties,Usage,Production

Chemical Properties

white to light yellow crystalline powder

Synthesis

110-91-8

17201-43-3

37812-51-4

1. 4-Cyanobenzyl bromide (2.28 g, 11.6 mmol) was dissolved in 25 mL of anhydrous acetonitrile under nitrogen protection. 2. To the above solution, morpholine (1.5 mL, 17.4 mmol) and potassium carbonate (0.69 g, 5 mmol) were added sequentially. 3. Stir the reaction mixture for 30 minutes at room temperature. 4. 4. Upon completion of the reaction, the reaction was quenched with water and extracted with ethyl acetate. 5. The organic layers were combined, dried over anhydrous magnesium sulfate and subsequently concentrated under reduced pressure. 6. 6. The crude product was purified by column chromatography (eluent: hexane-30% ethyl acetate/hexane) to give 4-(4-morpholinylmethyl)benzonitrile. 7. The product was a white solid. 7. The product was a white solid in 96% yield. 8. 8. 1H NMR (400 MHz, CDCl3) δ 7.61 (d, J = 7.9 Hz, 2H), 7.48 (d, J = 8.0 Hz, 2H), 3.71 (s, 4H), 3.55 (s, 2H), 2.44 (s, 4H); 13C NMR (100 MHz, CDCl3): 144.2, 132.5, 129.8, 119.2, 129.8, 119.2 129.8, 119.2, 111.3, 67.2, 63.1, 54.1.

References

[1] Journal of Medicinal Chemistry, 2012, vol. 55, # 5, p. 1844 - 1857
[2] Patent: WO2012/69856, 2012, A1. Location in patent: Page/Page column 67
[3] European Journal of Medicinal Chemistry, 2018, vol. 152, p. 31 - 52
[4] Patent: WO2013/153357, 2013, A1. Location in patent: Page/Page column 20; 41; 42
[5] Patent: US2015/45354, 2015, A1. Location in patent: Paragraph 0251-0254

4-(MORPHOLINOMETHYL)BENZONITRILE Preparation Products And Raw materials

Raw materials

Preparation Products

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4-(MORPHOLINOMETHYL)BENZONITRILE Suppliers

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37812-51-4, 4-(MORPHOLINOMETHYL)BENZONITRILERelated Search:

4-(MORPHOLINOMETHYL)BENZONITRILE 4-[(2,6-dimethylmorpholin-4-yl)methyl]-3-fluorobenzonitrile 4-(2-AMINOMETHYL-MORPHOLIN-4-YLMETHYL)-BENZONITRILE DIHYDROCHLORIDE 3-fluoro-4-[(2-methylmorpholin-4-yl)methyl]benzonitrile 4-[(2-methylmorpholin-4-yl)carbonyl]benzonitrile 4-[(2-methylmorpholin-4-yl)methyl]benzonitrile 4-(MORPHOLIN-4-YLCARBONYL)BENZONITRILE 3-fluoro-4-(morpholin-4-ylmethyl)benzonitrile 4-[(2,6-dimethylmorpholin-4-yl)methyl]benzonitrile 4-[(2,6-dimethylmorpholin-4-yl)carbonyl]benzonitrile

  • 4-(MORPHOLINOMETHYL)BENZONITRILE
  • 4-MORPHOLIN-4-YLMETHYLBENZONITRILE
  • 4-(4-MORPHOLINYLMETHYL)BENZONITRILE
  • p-Tolunitrile, alpha-(4-morpholinyl)-
  • 4-MORPHOLIN-4-YLMETHYLBENZONITRILE, 95+%
  • USAF A-3730
  • 4-(4-Morpholinylmethyl)benzonitrile,97%
  • 4-(morpholin-4-ylmethyl)benzonitrile hydrochloride
  • benzonitrile, 4-(4-morpholinylmethyl)-
  • BUTTPARK 98\57-96
  • N-(4-CYANOBENZYL)MORPHOLINE
  • 4-(4-morpholinylmethyl)-benzonitril
  • alpha-(4-morpholinyl)-p-tolunitril
  • alpha-(4-morpholinyl)-p-tolunitrile
  • 4-(Morpholinomethyl)
  • 37812-51-4
  • C12H14N2O
  • Aromatic Nitriles