5-CARBOXYBENZIMIDAZOLONE METHYL ESTER
- Product Name
- 5-CARBOXYBENZIMIDAZOLONE METHYL ESTER
- CAS No.
- 106429-57-6
- Chemical Name
- 5-CARBOXYBENZIMIDAZOLONE METHYL ESTER
- Synonyms
- 5- CARBOXYBENZIMIDAZOLONE;5-CARBOXYBENZIMIDAZOLONE METHYL ESTER;Methyl 2-Oxo-2,3-dihydrobenzimidazole-5-carboxylate;methyl 2-hydroxy-1H-benzo[d]imidazole-5-carboxylate;Methyl 2,3-dihydro-2-oxo-1H-benzimidazole-5-carboxylate;Methyl 2-oxo-1,3-dihydro-1,3-benzodiazole-5-carboxylate;methyl 2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-carboxylate;methyl 2-oxo-2,3-dihydro-1H-1,3-benzimidazole-5-carboxylate;Methyl 2-oxo-2,3-dihydro-1H-benzo[d]iMidazole-5-carboxylate;2-Oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid methyl ester
- CBNumber
- CB1215104
- Molecular Formula
- C9H8N2O3
- Formula Weight
- 192.17
- MOL File
- 106429-57-6.mol
5-CARBOXYBENZIMIDAZOLONE METHYL ESTER Property
- Melting point:
- 312-313°
- Boiling point:
- 221.2±19.0 °C(Predicted)
- Density
- 1.325±0.06 g/cm3(Predicted)
- storage temp.
- 2-8°C
- pka
- 11.54±0.30(Predicted)
- Appearance
- Light brown to gray Solid
Safety
- HazardClass
- IRRITANT
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
H302Harmful if swallowed
H315Causes skin irritation
H319Causes serious eye irritation
H335May cause respiratory irritation
- Precautionary statements
-
P261Avoid breathing dust/fume/gas/mist/vapours/spray.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
N-Bromosuccinimide Price
- Product number
- 046773
- Product name
- Methyl 2-oxo-2,3-dihydro-1H-1,3-benzimidazole-5-carboxylate
- Purity
- >95%
- Packaging
- 500mg
- Price
- $77
- Updated
- 2021/12/16
- Product number
- 046773
- Product name
- Methyl 2-oxo-2,3-dihydro-1H-1,3-benzimidazole-5-carboxylate
- Purity
- >95%
- Packaging
- 1g
- Price
- $119
- Updated
- 2021/12/16
- Product number
- X8804
- Product name
- Methyl2-oxo-2,3-dihydro-1H-benzo[d]imidazole-5-carboxylate
- Packaging
- 1g
- Price
- $212
- Updated
- 2021/12/16
- Product number
- BP-20127
- Product name
- methyl2-hydroxy-3H-benzo[d]imidazole-5-carboxylate
- Purity
- 96%
- Packaging
- 500mg
- Price
- $320
- Updated
- 2021/12/16
- Product number
- 046773
- Product name
- Methyl 2-oxo-2,3-dihydro-1H-1,3-benzimidazole-5-carboxylate
- Purity
- >95%
- Packaging
- 5g
- Price
- $440
- Updated
- 2021/12/16
5-CARBOXYBENZIMIDAZOLONE METHYL ESTER Chemical Properties,Usage,Production
Synthesis
36692-49-6
530-62-1
106429-57-6
Methyl 3,4-diaminobenzoate (5.00 g, 30.1 mmol) was dissolved in THF (40 mL) at 0 °C, followed by the addition of N,N'-carbonyldiimidazole (7.32 g, 45.1 mmol). The reaction mixture was stirred at 0 °C for 16 h and gradually warmed up to 23 °C. Upon completion of the reaction, 1M HCl aqueous solution (50 mL) was slowly added followed by water (70 mL) at 0 °C and stirring was continued for 1 hour. The resulting precipitate was collected by filtration and dried under reduced pressure for 18 h to afford methyl 2-oxo-2,3-dihydro-1H-benzo[d]imidazole-5-carboxylate (5.45 g, 94% yield), and the product could be used for subsequent reactions without further purification. Mass spectrum (ESI/CI): calculated value C9H8N2O3, 192.1; measured value m/z 193.1 [M+H]+. 1H NMR (400 MHz, CDCl3) δ: 11.01 (s, 1H), 10.84 (s, 1H), 7.63 (dd, J=8.2,1.6Hz, 1H), 7.47 (s, 1H). 7.02 (d, J=8.2Hz, 1H), 3.82 (s, 3H).
References
[1] Patent: WO2009/134750, 2009, A1. Location in patent: Page/Page column 139
[2] Journal of Medicinal Chemistry, 2006, vol. 49, # 12, p. 3719 - 3742
[3] Patent: US2010/249124, 2010, A1. Location in patent: Page/Page column 62
[4] Cell Chemical Biology, 2018, vol. 25, # 6, p. 677 - 12,690
5-CARBOXYBENZIMIDAZOLONE METHYL ESTER Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from 5-CARBOXYBENZIMIDAZOLONE METHYL ESTER manufacturers
- Product
- 5-CARBOXYBENZIMIDAZOLONE METHYL ESTER 106429-57-6
- Price
- US $0.01/KG
- Min. Order
- 1KG
- Purity
- 98%; 99%
- Supply Ability
- 500g; 1kg; 25kg
- Release date
- 2020-01-10
- Product
- 5-CARBOXYBENZIMIDAZOLONE METHYL ESTER 106429-57-6
- Price
- US $1.00/KG
- Min. Order
- 1KG
- Purity
- 95%~99%
- Supply Ability
- 1ton
- Release date
- 2019-12-18