ChemicalBook > CAS DataBase List > Methyl 2-(broMoMethyl)-5-cyanobenzoate

Methyl 2-(broMoMethyl)-5-cyanobenzoate

Product Name: Methyl 2-(broMoMethyl)-5-cyanobenzoate
CAS No.: 421551-82-8
Chemical Name: Methyl 2-(broMoMethyl)-5-cyanobenzoate
Synonyms: Methyl 2-(broMoMethyl)-5-cyanobenzoate;2-Bromomethyl-5-cyano-benzoic acid methyl ester;Benzenepropanoicacid,7-chloro-β-oxo-,methylester;Benzoic acid, 2-(bromomethyl)-5-cyano-, methyl ester
CBNumber: CB72686564
Molecular Formula: C10H8BrNO2
Formula Weight: 254.08
MOL File: 421551-82-8.mol

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Methyl 2-(broMoMethyl)-5-cyanobenzoate Property

storage temp.: under inert gas (nitrogen or Argon) at 2-8°C
Appearance: White to off-white Solid

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Safety

HS Code: 2926907090

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Hazard and Precautionary Statements (GHS)

Symbol(GHS)

Signal word

Danger

Hazard statements

H315Causes skin irritation

H318Causes serious eye damage

H335May cause respiratory 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.

P310Immediately call a POISON CENTER or doctor/physician.

P321Specific treatment (see … on this label).

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

P362Take off contaminated clothing and wash before reuse.

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N-Bromosuccinimide Price

AK Scientific

Product number: Y1254
Product name: Methyl2-(bromomethyl)-5-cyanobenzoate
Packaging: 100mg
Price: $107
Updated: 2021/12/16

SynQuest Laboratories

Product number: 4737-9-02
Product name: Methyl 2-(bromomethyl)-5-cyanobenzoate
Purity: 95.0%
Packaging: 250mg
Price: $212
Updated: 2021/12/16

J&W Pharmlab

Product number: 05R0679
Product name: 2-Bromomethyl-5-cyano-benzoicacidmethylester
Purity: 96%
Packaging: 1g
Price: $250
Updated: 2021/12/16

Crysdot

Product number: CD12072925
Product name: Methyl2-(bromomethyl)-5-cyanobenzoate
Purity: 95+%
Packaging: 1g
Price: $390
Updated: 2021/12/16

Alichem

Product number: 421551828
Product name: Methyl2-(bromomethyl)-5-cyanobenzoate
Packaging: 250mg
Price: $494.4
Updated: 2021/12/16

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Methyl 2-(broMoMethyl)-5-cyanobenzoate Chemical Properties,Usage,Production

Synthesis

103261-68-3

421551-82-8

B) Synthesis of methyl 2-(bromomethyl)-5-cyanobenzoate Methyl 5-cyano-2-methylbenzoate (8.9 g), N-bromosuccinimide (9.5 g), 2,2'-azobis(isobutyronitrile) (0.83 g) were mixed with (trifluoromethyl)benzene (200 mL) and the reaction was stirred for 6 hours at 80 °C under nitrogen protection. Upon completion of the reaction, the mixture was poured into water, the organic layer was separated and dried over anhydrous sodium sulfate, and subsequently concentrated under reduced pressure. The residue was purified by silica gel column chromatography (eluent: hexane/ethyl acetate) to afford the target product methyl 2-(bromomethyl)-5-cyanobenzoate (8.05 g). The product was characterized by 1H NMR (300 MHz, CDCl3) with chemical shifts of δ3.98 (3H, s), 4.96 (2H, s), 7.61 (1H, d, J = 7.9 Hz), 7.77 (1H, dd, J = 7.9,1.9 Hz), 8.27 (1H, d, J = 1.9 Hz).

References

[1] Bioorganic and Medicinal Chemistry Letters, 2007, vol. 17, # 10, p. 2823 - 2827
[2] Patent: WO2004/18414, 2004, A2. Location in patent: Page 108-109
[3] Journal of Medicinal Chemistry, 2004, vol. 47, # 3, p. 612 - 626
[4] Patent: US2017/15655, 2017, A1. Location in patent: Paragraph 1108-1109
[5] Patent: EP3327019, 2018, A1. Location in patent: Paragraph 0274

Methyl 2-(broMoMethyl)-5-cyanobenzoate Preparation Products And Raw materials

Raw materials

Preparation Products

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421551-82-8, Methyl 2-(broMoMethyl)-5-cyanobenzoateRelated Search:

Methyl 2-(broMoMethyl)-5-cyanobenzoate

2-Bromomethyl-5-cyano-benzoic acid methyl ester

Benzoic acid, 2-(bromomethyl)-5-cyano-, methyl ester

Benzenepropanoicacid,7-chloro-β-oxo-,methylester

421551-82-8