Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate
Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate structure
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Common Name | Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate | ||
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| CAS Number | 95058-92-7 | Molecular Weight | 254.228 | |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 338.4±37.0 °C at 760 mmHg | |
| Molecular Formula | C10H16F2O5 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 158.5±26.5 °C | |
Summary: Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate, also known as (3R,S)-2,2-difluoro-3-hydroxy-(2,2-dimethyldioxolan-4-yl)propionic acid ethyl ester, has a CAS number of 95058-92-7, with a molecular formula of C10H16F2O5. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.2±0.1 g/cm3 |
|---|---|
| Boiling Point | 338.4±37.0 °C at 760 mmHg |
| Molecular Formula | C10H16F2O5 |
| Molecular Weight | 254.228 |
| Flash Point | 158.5±26.5 °C |
| Exact Mass | 254.096573 |
| PSA | 64.99000 |
| LogP | 1.86 |
| Vapour Pressure | 0.0±1.7 mmHg at 25°C |
| Index of Refraction | 1.428 |
| InChIKey | OUFRYOWGFSOSEY-RNFRBKRXSA-N |
| SMILES | CCOC(=O)C(F)(F)C(O)C1COC(C)(C)O1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2942000000 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~75%
Ethyl (3R,S)-2,... CAS#:95058-92-7 |
| Literature: PHARMAESSENTIA CORP. Patent: WO2006/119347 A1, 2006 ; Location in patent: Page/Page column 9-10 ; |
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~98%
Ethyl (3R,S)-2,... CAS#:95058-92-7 |
| Literature: CHEMAGIS LTD.; PERRIGO COMPANY Patent: WO2007/70804 A2, 2007 ; Location in patent: Page/Page column 24-25 ; |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 2 | |
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| DownStream 1 | |
CAS#:143234-90-6This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2932999099 |
|---|---|
| Summary | 2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| ethyl 2-deoxy-2,2-difluoro-D-erythro,D-threo-pentonate |
| ethyl (3R,4R)-3-(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-difluoro-3-hydroxypropanoate |
| Ethyl(3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate |
| ethyl 2,2-difluoro-3-hydroxy-3-(2,2-dimethyl-[1,3]dioxolan-4-yl)propionate |
| 2-DEOXY-2,2-DIFLUORO-4,5-O-(1-METHYLETHYLIDENE)-D-ERYTHROPENTONIC ACID ETHYL ESTER |
| ethyl (D-erythro)-3-(hydroxy)-2,2-difluoro-3-(2,2-dimethyldioxalane-4-yl)propionate |
| (R)-ethyl 3-((R)-2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-difluoro-3-hydroxypropanoate |
| Pentonicacid, 2-deoxy-2,2-difluoro-4,5-O-(1-methylethylidene)-ethylester |
| Pentonic acid,2-deoxy-2,2-difluoro-4,5-O |
| D-erythro-Pentonic acid,2-deoxy-2,2-difluoro-4,5-O-(1-methylethylidene)-,ethyl ester (9CI) |
| 2-Deoxy-2,2-Difluoro-4,5-o-(1-Methylethylidene) Pentonic Acid Ethyl Ester |
| Ethyl(3RS)-2,2-Difluoro-3-(2,2-Dimethylioxolan-4-yl)Propionate |
| ethyl (R)-2,2-difluoro-3-hydroxy-3-((R)-2,2-dimethyl-[1,3]dioxoran-4-yl)propionate |
| D-ERYTHRO-PENTONIC ACID,2-DEOXY-2,2-DIFLUORO-4,5-O-(1-METHYLETHYLIDENE)-,ETHYL ESTER |
| ethyl 2,2-difluoro-3-hydroxy-3-(2,2-dimethyl-dioxolan-4-yl)propionate |
| 2-Deoxy-2,2-difluoro-4,5-O-isopropylidene-D-erythro-pentonic Acid Ethyl Ester |
| Ethyl 3-(2,2-diMethyl-1,3-dioxolan-4-yl)-2,2-difluoro-3-hydroxypropanoate |
| (erytro) ethyl-3-(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-difluoro-3-hydroxy propionate |
| ethyl (3R)-3-(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-difluoro-3-hydroxypropanoate |
| (1-methylethylidene)-,ethylester |
| propionate (T3) |
| Pentonic acid, 2-deoxy-2,2-difluoro-4,5-O-(1-methylethylidene)-, ethyl ester |
| ethyl 2,2-difluoro-3(R)-hydroxy-3-((R)-2,2-dimethyldioxolan-4-yl)propionate |
| Ethyl 2-deoxy-2,2-difluoro-4,5-O-isopropylidenepentonate |
| 3-(2,2-Dimethyl[1,3]dioxolan-4-yl)-2,2-difluora-3-hydroxy-propionic acid ethyl ester |
| Ethyl(3RS)-2,2-Difluoro-3-(2,2-dimethyldioxolan-4-yl)propionate |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the InChIKey of Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate? |
| A: InChIKey of Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate is OUFRYOWGFSOSEY-RNFRBKRXSA-N. |
| Q: What is the SMILES notation of Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate? |
| A: SMILES notation of Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate is CCOC(=O)C(F)(F)C(O)C1COC(C)(C)O1. |
| Q: What are the downstream products of Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate? |
| A: Related downstream products(CAS) of Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate: 143234-90-6. |
| Q: What is the boiling point of Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate? |
| A: Boiling point of Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate is 338.4±37.0 °C at 760 mmHg. |
| Q: What is the English name of Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate? |
| A: The English name of Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate is Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate. |
| Q: What is the CAS number of Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate? |
| A: CAS number of Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate is 95058-92-7. |
| Q: What is the polar surface area (PSA) of Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate? |
| A: Polar surface area (PSA) of Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate is 64.99000. |
| Q: What is the LogP of Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate? |
| A: LogP of Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate is 1.86. |
| Q: What are the upstream materials of Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate? |
| A: Related upstream materials(CAS) of Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate: 667-27-6;15186-48-8. |
| Q: What is the molecular formula of Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate? |
| A: Molecular formula of Ethyl (3R,S)-2,2-difluoro-3-hydroxy-3-(2,2-dimethyldioxolan-4-yl)propionate is C10H16F2O5. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |