ChemicalBook > CAS DataBase List > 3-Hydroxy-2-methylbenzonitrile

3-Hydroxy-2-methylbenzonitrile

Product Name
3-Hydroxy-2-methylbenzonitrile
CAS No.
55289-04-8
Chemical Name
3-Hydroxy-2-methylbenzonitrile
Synonyms
3-Hydroxy-2-methylbenzonitrile;Benzonitrile, 3-hydroxy-2-methyl-
CBNumber
CB0971685
Molecular Formula
C8H7NO
Formula Weight
133.15
MOL File
55289-04-8.mol
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3-Hydroxy-2-methylbenzonitrile Property

Melting point:
110-111 °C
Boiling point:
263.4±28.0 °C(Predicted)
Density 
1.17±0.1 g/cm3(Predicted)
storage temp. 
Sealed in dry,Room Temperature
pka
8.93±0.10(Predicted)
Appearance
Light yellow to yellow Solid
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Hazard and Precautionary Statements (GHS)

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N-Bromosuccinimide Price

TRC
Product number
H972650
Product name
3-Hydroxy-2-methylbenzonitrile
Packaging
100mg
Price
$230
Updated
2021/12/16
TRC
Product number
H972650
Product name
3-Hydroxy-2-methylbenzonitrile
Packaging
250mg
Price
$415
Updated
2021/12/16
Matrix Scientific
Product number
119039
Product name
3-Hydroxy-2-methylbenzonitrile
Purity
95+%
Packaging
250mg
Price
$252
Updated
2021/12/16
AK Scientific
Product number
Z4876
Product name
3-Hydroxy-2-methylbenzonitrile
Packaging
250mg
Price
$127
Updated
2021/12/16
Matrix Scientific
Product number
119039
Product name
3-Hydroxy-2-methylbenzonitrile
Purity
95+%
Packaging
1g
Price
$630
Updated
2021/12/16
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3-Hydroxy-2-methylbenzonitrile Chemical Properties,Usage,Production

Synthesis

77533-17-6

55289-04-8

General procedure: Preparation of 3-hydroxy-2-methylbenzonitrile (Compound 74): 3-methoxy-2-methylbenzonitrile (1 g, 6.79 mmol) and tetra-n-butylammonium iodide (4.12 g, 17 mmol) were dissolved in dichloromethane (15 mL), the solution was cooled to -78 °C and purged with nitrogen. Boron trichloride (1 M solution in dichloromethane, 17 mL, 17 mmol) was added dropwise at -78 °C and the mixture was then stirred at -78 °C for 15 min, followed by warming to room temperature and continued stirring for 3 hours. Upon completion of the reaction, the reaction mixture was quenched with water, stirred for 30 minutes and subsequently concentrated under vacuum. The aqueous residue was extracted with ether, the organic phases were combined and washed five times with water, dried with magnesium sulfate and finally concentrated under vacuum to give 3-hydroxy-2-methylbenzonitrile as a brown solid in 91% yield (826 mg). The product was confirmed by 1H NMR (400 MHz, CDCl3): δ 2.20 (s, 3H), 7.10 (m, 1H), 7.20 (d, 1H), 10.10 (s, 1H); LRMS APCI m/z 132 [M-H]-.

References

[1] Patent: US2006/160786, 2006, A1. Location in patent: Page/Page column 36-37

3-Hydroxy-2-methylbenzonitrile Preparation Products And Raw materials

Raw materials

Preparation Products

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