1-(2,2-Difluoro-benzo[1,3]dioxol-5-yl)-cyclopropanecarboxylicacid
- Product Name
- 1-(2,2-Difluoro-benzo[1,3]dioxol-5-yl)-cyclopropanecarboxylicacid
- CAS No.
- 862574-88-7
- Chemical Name
- 1-(2,2-Difluoro-benzo[1,3]dioxol-5-yl)-cyclopropanecarboxylicacid
- Synonyms
- 1-(2,2-difluorobenzo[d][1,3]dioxol-5-yl)cyclopropanecarboxylic acid;EOS-61000;1-(2,2-DifL;uorobenzo[1,3]dioxoL;Lumacator intermediate;Tezacaftor intermediate 03;1-(2,2-Difluorobenzo[1,3]dioxol-5-yl);1-(2,2-Difluoro-benzo[1,3]dioxol-5-yl)-cyclopropan;1-(2,2-Difluorobenzodioxol-5-yl)cyclopropanecarboxylic acid;1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxyl
- CBNumber
- CB12489626
- Molecular Formula
- C11H8F2O4
- Formula Weight
- 242.18
- MOL File
- 862574-88-7.mol
1-(2,2-Difluoro-benzo[1,3]dioxol-5-yl)-cyclopropanecarboxylicacid Property
- Boiling point:
- 331.1±42.0 °C(Predicted)
- Density
- 1.59±0.1 g/cm3(Predicted)
- storage temp.
- Inert atmosphere,Room Temperature
- solubility
- Chloroform; Dichloromethane; Methanol
- pka
- 4.03±0.20(Predicted)
- form
- Solid
- color
- White
- InChI
- InChI=1S/C11H8F2O4/c12-11(13)16-7-2-1-6(5-8(7)17-11)10(3-4-10)9(14)15/h1-2,5H,3-4H2,(H,14,15)
- InChIKey
- IELWGOUPQRHXLS-UHFFFAOYSA-N
- SMILES
- C1(C2=CC=C3OC(F)(F)OC3=C2)(C(O)=O)CC1
Safety
- HS Code
- 2932990025
- Storage Class
- 11 - Combustible Solids
- Hazard Classifications
- Acute Tox. 4 Oral
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.
P301+P312IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P302+P352IF ON SKIN: wash with plenty of soap and water.
P304+P340IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
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
- D445673
- Product name
- 1-(2,2-Difluorobenzo[1,3]dioxol-5-yl)cyclopropanecarboxylicAcid
- Packaging
- 5g
- Price
- $60
- Updated
- 2021/12/16
- Product number
- D445673
- Product name
- 1-(2,2-Difluorobenzo[1,3]dioxol-5-yl)cyclopropanecarboxylicAcid
- Packaging
- 1g
- Price
- $40
- Updated
- 2021/12/16
- Product number
- CS-M2012
- Product name
- Cyclopropanecarboxylicacid,1-(2,2-difluoro-1,3-benzodioxol-5-yl)-
- Purity
- 99.92%
- Packaging
- 10g
- Price
- $58
- Updated
- 2021/12/16
- Product number
- CS-M2012
- Product name
- Cyclopropanecarboxylicacid,1-(2,2-difluoro-1,3-benzodioxol-5-yl)-
- Purity
- 99.92%
- Packaging
- 25g
- Price
- $121
- Updated
- 2021/12/16
- Product number
- FD105869
- Product name
- 1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxyl
- Packaging
- 2g
- Price
- $130
- Updated
- 2021/12/16
1-(2,2-Difluoro-benzo[1,3]dioxol-5-yl)-cyclopropanecarboxylicacid Chemical Properties,Usage,Production
Uses
1-(2,2-Difluorobenzo[1,3]dioxol-5-yl)cyclopropanecarboxylic Acid is used in processes for preparation of Tezacaftor and intermediates thereof.
Synthesis
Compound 21 was hydrolyzed with 6 M NaOH (8 eq.) in ethanol (5 v/v) at 80C. The mixture was cooled to room temperature during the night and the ethanol was evaporated under vacuum. The residue was put into water, MTBE, 1 M HCl was added and the layers were separated. The MTBE layer was then treated with dicyclohexylamine (0.97 eq.). The slurry was cooled to 0C., filtered and washed with heptane to obtain the corresponding DCHA salt. The salts were placed in MTBE and 10% citric acid and stirred until all solids were dissolved. The layers were separated and the MTBE layer was washed with water and brine. After drying in a vacuum oven at 50C, the solvent was exchanged to heptane and then filtered to give compound 1-(2,2-difluorobenzo[D][1,3]dioxol-5-yl)cyclopropanecarboxylic acid. Yield 69%.
1-(2,2-Difluoro-benzo[1,3]dioxol-5-yl)-cyclopropanecarboxylicacid Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from 1-(2,2-Difluoro-benzo[1,3]dioxol-5-yl)-cyclopropanecarboxylicacid manufacturers
- Product
- 1-(2,2-Difluoro-benzo[1,3]dioxol-5-yl)-cyclopropanecarboxylicacid 862574-88-7
- Price
- US $0.00-0.00/KG
- Min. Order
- 1KG
- Purity
- 98.0%
- Supply Ability
- 10000KGS
- Release date
- 2025-06-06
- Product
- 1-(2,2-Difluoro-benzo[1,3]dioxol-5-yl)-cyclopropanecarboxylicacid 862574-88-7
- Price
- US $0.00-0.00/KG
- Min. Order
- 1KG
- Purity
- 98%
- Supply Ability
- 1ton
- Release date
- 2022-09-27
- Product
- 1-(2,2-Difluoro-benzo[1,3]dioxol-5-yl)-cyclopropanecarboxylicacid 862574-88-7
- Price
- US $0.00/KG
- Min. Order
- 0.1KG
- Purity
- 98%
- Supply Ability
- 1000KGS
- Release date
- 2023-07-14