ChemicalBook > CAS DataBase List > Methyl 2-bromomethyl-4-cyanobenzoate
Methyl 2-bromomethyl-4-cyanobenzoate
- Product Name
- Methyl 2-bromomethyl-4-cyanobenzoate
- CAS No.
- 165111-46-6
- Chemical Name
- Methyl 2-bromomethyl-4-cyanobenzoate
- Synonyms
- Methyl 2-bromomethyl-4-cyanobenzoate;Benzoic acid, 2-(bromomethyl)-4-cyano-, methyl ester
- CBNumber
- CB7947900
- Molecular Formula
- C10H8BrNO2
- Formula Weight
- 254.08
- MOL File
- Mol file
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Methyl 2-bromomethyl-4-cyanobenzoate Property
- Boiling point:
- 380.5±37.0 °C(Predicted)
- Density
- 1.53±0.1 g/cm3(Predicted)
- storage temp.
- under inert gas (nitrogen or Argon) at 2-8°C
- Appearance
- White to off-white Solid
- InChI
- InChI=1S/C10H8BrNO2/c1-14-10(13)9-3-2-7(6-12)4-8(9)5-11/h2-4H,5H2,1H3
- InChIKey
- QMLVCVLSZNSKJM-UHFFFAOYSA-N
- SMILES
- C(OC)(=O)C1=CC=C(C#N)C=C1CBr
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Safety
- HS Code
- 2916399090
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N-Bromosuccinimide Price
SynQuest Laboratories
- Product number
- 4637-9-Y3
- Product name
- Methyl 2-bromomethyl-4-cyanobenzoate
- Purity
- 95.0%
- Packaging
- 1g
- Price
- $116
- Updated
- 2021/12/16
AK Scientific
- Product number
- 8384AA
- Product name
- Methyl2-(bromomethyl)-4-cyanobenzoate
- Packaging
- 1g
- Price
- $195
- Updated
- 2021/12/16
American Custom Chemicals Corporation
- Product number
- HCH0007552
- Product name
- METHYL 2-BROMOMETHYL-4-CYANOBENZOATE
- Purity
- 95.00%
- Packaging
- 5G
- Price
- $1994.98
- Updated
- 2021/12/16
Crysdot
- Product number
- CD12135557
- Product name
- Methyl2-(bromomethyl)-4-cyanobenzoate
- Purity
- 95+%
- Packaging
- 5g
- Price
- $380
- Updated
- 2021/12/16
Ambeed
- Product number
- A152862
- Product name
- Methyl2-(bromomethyl)-4-cyanobenzoate
- Purity
- 95%
- Packaging
- 5g
- Price
- $462
- Updated
- 2021/12/16
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Methyl 2-bromomethyl-4-cyanobenzoate Chemical Properties,Usage,Production
Synthesis
103261-67-2
165111-46-6
General procedure for the synthesis of methyl 2-bromomethyl-4-cyanobenzoate from methyl 4-cyano-2-methylbenzoate: Methyl 4-cyano-2-methylbenzoate (4.0 g, 22.83 mmol) was dissolved in carbon tetrachloride (150 mL) and N-bromosuccinimide (NBS, 4.88 g, 27.4 mmol) was added to form a suspension. The suspension was heated at 80 °C for 5 min. Subsequently, azobisisobutyronitrile (AIBN, 1.88 g, 11.42 mmol) was added and stirred continuously at 80 °C for 16 hours. After completion of the reaction, the mixture was cooled to room temperature and filtered. The filtrate was concentrated to give the crude product. Purification by silica gel column chromatography using a solvent mixture of ethyl acetate (EA) and petroleum ether (gradient elution, 0% to 5% EA) resulted in methyl 2-bromomethyl-4-cyanobenzoate (3.84 g, 66.9% yield) as a white solid.
References
[1] Patent: WO2017/201069, 2017, A1. Location in patent: Paragraph 0510
[2] Patent: US5591752, 1997, A
[3] Patent: US2009/82368, 2009, A1. Location in patent: Page/Page column 41-42
[4] Patent: WO2013/79452, 2013, A1. Location in patent: Page/Page column 165
[5] Patent: US2014/45855, 2014, A1. Location in patent: Paragraph 0552
Methyl 2-bromomethyl-4-cyanobenzoate Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from Methyl 2-bromomethyl-4-cyanobenzoate manufacturers
Shaanxi Dideu New Materials Co. Ltd
- Product
- Methyl 2-bromomethyl-4-cyanobenzoate 165111-46-6
- Price
- US $0.00/kg
- Min. Order
- 1kg
- Purity
- 98%
- Supply Ability
- 1000kg
- Release date
- 2025-09-29