Carbamic acid, (3-ethynylphenyl)-, 1,1-dimethylethyl ester (9CI)
- Product Name
- Carbamic acid, (3-ethynylphenyl)-, 1,1-dimethylethyl ester (9CI)
- CAS No.
- 185619-66-3
- Chemical Name
- Carbamic acid, (3-ethynylphenyl)-, 1,1-dimethylethyl ester (9CI)
- Synonyms
- N-Boc-3-ethynylaniline;tert-butyl 3-ethynylphenylcarbamate;tert-butyl N-(3-ethynylphenyl)carbamate;tert-Butyl (3-ethynylphenyl)carbamate - [B56910];Carbamic acid, N-(3-ethynylphenyl)-, 1,1-dimethylethyl ester;Carbamic acid, (3-ethynylphenyl)-, 1,1-dimethylethyl ester (9CI)
- CBNumber
- CB91054814
- Molecular Formula
- C13H15NO2
- Formula Weight
- 217.26
- MOL File
- 185619-66-3.mol
Carbamic acid, (3-ethynylphenyl)-, 1,1-dimethylethyl ester (9CI) Property
- storage temp.
- 2-8°C
- form
- solid
- color
- Grey
Safety
- HS Code
- 2924297099
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
H302Harmful if swallowed
- Precautionary statements
-
P280Wear protective gloves/protective clothing/eye protection/face protection.
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
- B56910
- Product name
- tert-Butyl(3-ethynylphenyl)carbamate
- Purity
- 97%
- Packaging
- 250mg
- Price
- $40
- Updated
- 2021/12/16
- Product number
- B56910
- Product name
- tert-Butyl(3-ethynylphenyl)carbamate
- Purity
- 97%
- Packaging
- 1g
- Price
- $90
- Updated
- 2021/12/16
- Product number
- 9710AA
- Product name
- tert-Butyl(3-ethynylphenyl)carbamate
- Packaging
- 1g
- Price
- $277
- Updated
- 2021/12/16
- Product number
- B56910
- Product name
- tert-Butyl(3-ethynylphenyl)carbamate
- Purity
- 97%
- Packaging
- 5g
- Price
- $390
- Updated
- 2021/12/16
- Product number
- CHM0097306
- Product name
- TERT-BUTYL 3-ETHYNYLPHENYLCARBAMATE
- Purity
- 95.00%
- Packaging
- 5MG
- Price
- $499.55
- Updated
- 2021/12/16
Carbamic acid, (3-ethynylphenyl)-, 1,1-dimethylethyl ester (9CI) Chemical Properties,Usage,Production
Synthesis
24424-99-5
54060-30-9
185619-66-3
Step a) Synthesis of tert-butyl (3-ethynylphenyl)carbamate: 3-ethynylaniline (25.0 g, 213 mmol) and di-tert-butyl dicarbonate (93.1 g, 427 mmol) were dissolved in THF (427 mL) and the reaction was heated at 70 °C overnight. After the reaction was completed, it was cooled to room temperature, 3-dimethylamino-1-propylamine (32.1 g, 320 mmol) was added and stirred at room temperature for 1 hour. The reaction mixture was concentrated, extracted with ether and washed sequentially with 1N HCl, saturated saline, saturated sodium bicarbonate solution and saturated saline. The organic layer was dried with anhydrous sodium sulfate and concentrated under reduced pressure to afford the target product tert-butyl (3-alkynylphenyl)carbamate (45.0 g, 97% yield). The structure of the product was confirmed by NMR and mass spectrometry.
References
[1] Journal of Medicinal Chemistry, 2003, vol. 46, # 20, p. 4232 - 4235
[2] Patent: US2009/48320, 2009, A1. Location in patent: Page/Page column 39-40
[3] Patent: WO2005/60970, 2005, A1. Location in patent: Page/Page column 148
[4] Patent: WO2017/210471, 2017, A1. Location in patent: Paragraph 001146; 001147
[5] Patent: WO2008/61236, 2008, A2. Location in patent: Page/Page column 71
Carbamic acid, (3-ethynylphenyl)-, 1,1-dimethylethyl ester (9CI) Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from Carbamic acid, (3-ethynylphenyl)-, 1,1-dimethylethyl ester (9CI) manufacturers
- Product
- TERT-BUTYL (3-ETHYNYLPHENYL)CARBAMATE 185619-66-3
- Price
- US $100.00/KG
- Min. Order
- 1KG
- Purity
- 98%
- Supply Ability
- 100KG
- Release date
- 2021-09-13
- Product
- tert-butyl N-(3-ethynylphenyl)carbamate 185619-66-3
- Price
- US $100.00/Kg/Bag
- Min. Order
- 1Kg/Bag
- Purity
- 98%
- Supply Ability
- 10KG
- Release date
- 2021-09-14
- Product
- TERT-BUTYL (3-ETHYNYLPHENYL)CARBAMATE 185619-66-3
- Price
- US $100.00/Kg/Bag
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- 10kg
- Release date
- 2021-09-15