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ChemicalBook > CAS DataBase List > methyl 4-cyano-2-methylbenzoate

methyl 4-cyano-2-methylbenzoate

Uses
Product Name
methyl 4-cyano-2-methylbenzoate
CAS No.
103261-67-2
Chemical Name
methyl 4-cyano-2-methylbenzoate
Synonyms
methyl 4-cyano-2-methylbenzoate;methyl 4-cyano-2-methylbenzoate 97%;4-cyano-2-methylBenzoic acid methyl ester;Benzoic acid, 4-cyano-2-methyl-, methyl ester;Methyl4-cyano2-methylbenzoateMethyl4-cyano2-methylbenzoate
CBNumber
CB02514738
Molecular Formula
C10H9NO2
Formula Weight
175.18
MOL File
103261-67-2.mol
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methyl 4-cyano-2-methylbenzoate Property

Boiling point:
302.7±30.0 °C(Predicted)
Density 
1.15±0.1 g/cm3(Predicted)
storage temp. 
Sealed in dry,Room Temperature
Appearance
Off-white to brown Solid
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Safety

HS Code 
2926907090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H315Causes skin irritation

H319Causes serious eye irritation

Precautionary statements

P264Wash hands thoroughly after handling.

P264Wash skin thouroughly after handling.

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

P302+P352IF ON SKIN: wash with plenty of soap and water.

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

P332+P313IF SKIN irritation occurs: Get medical advice/attention.

P337+P313IF eye irritation persists: Get medical advice/attention.

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N-Bromosuccinimide Price

TRC
Product number
B495053
Product name
Methyl4-Cyano-2-methylbenzoate
Packaging
100mg
Price
$75
Updated
2021/12/16
AK Scientific
Product number
0775AA
Product name
Methyl4-cyano-2-methylbenzoate
Packaging
1g
Price
$104
Updated
2021/12/16
Apolloscientific
Product number
OR916717
Product name
Methyl 4-cyano-2-methylbenzoate
Packaging
1g
Price
$176
Updated
2021/12/16
American Custom Chemicals Corporation
Product number
CHM0393161
Product name
METHYL-4-CYANO-2-METHYLBENZOATE
Purity
95.00%
Packaging
5MG
Price
$502.3
Updated
2021/12/16
Apolloscientific
Product number
OR916717
Product name
Methyl 4-cyano-2-methylbenzoate
Packaging
5g
Price
$649
Updated
2021/12/16
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methyl 4-cyano-2-methylbenzoate Chemical Properties,Usage,Production

Uses

Methyl 4-cyano-2-methylbenzoate is a carboxylate derivative and can be used as an intermediate in organic synthesis.

Synthesis

557-21-1

99548-55-7

103261-67-2

Example 3.6: Preparation of methyl 4-bromo-2-methylbenzoate; Methyl 4-bromo-2-methylbenzoate (108 g, 471 mmol) was dissolved in N,N-dimethylformamide (4 L) under nitrogen protection followed by the addition of zinc(II) cyanide (88.5 g, 753.6 mmol) and tetrakis(triphenylphosphine)palladium(0) (65 g, 56.60 mmol). The reaction mixture was stirred at 100 °C for 16 hours. After completion of the reaction, the reaction mixture was diluted with toluene for phase separation. The aqueous phase was extracted twice with toluene. All organic phases were combined and washed sequentially with brine and saturated aqueous ammonium hydroxide solution, dried over anhydrous sodium sulfate and concentrated. The crude product was purified by silica gel column chromatography (eluent: ethyl acetate/cyclohexane, 1:5, v/v) to afford methyl 4-cyano-2-methylbenzoate (73 g, 89% yield).1H NMR (400 MHz, CDCl3): δ 7.78 (d, 1H), 7.52 (m, 2H), 3.92 (s, 3H), 2.62 (s, 3H).

References

[1] Patent: WO2010/127926, 2010, A1. Location in patent: Page/Page column 46
[2] Patent: WO2010/127928, 2010, A1. Location in patent: Page/Page column 32
[3] ChemBioChem, 2016, vol. 17, # 8, p. 759 - 767
[4] Patent: US2012/129832, 2012, A1. Location in patent: Page/Page column 11-12
[5] Patent: WO2013/75083, 2013, A1. Location in patent: Paragraph 00467; 00469

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Raw materials

Preparation Products

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103261-67-2, methyl 4-cyano-2-methylbenzoateRelated Search:


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