tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate
![tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate Structure](https://image.chemsrc.com/caspic/244/154026-94-5.png)
tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate structure
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Common Name | tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate | ||
|---|---|---|---|---|
| CAS Number | 154026-94-5 | Molecular Weight | 278.772 | |
| Density | 1.0±0.1 g/cm3 | Boiling Point | 326.2±22.0 °C at 760 mmHg | |
| Molecular Formula | C13H23ClO4 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 113.6±21.3 °C | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate |
|---|---|
| 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 | 1.0±0.1 g/cm3 |
|---|---|
| Boiling Point | 326.2±22.0 °C at 760 mmHg |
| Molecular Formula | C13H23ClO4 |
| Molecular Weight | 278.772 |
| Flash Point | 113.6±21.3 °C |
| Exact Mass | 278.128479 |
| PSA | 44.76000 |
| LogP | 2.56 |
| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
| Index of Refraction | 1.439 |
| InChIKey | TXLXWCARAPIXGH-ZJUUUORDSA-N |
| SMILES | CC(C)(C)OC(=O)CC1CC(CCl)OC(C)(C)O1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~79%
tert-butyl 2-[(... CAS#:154026-94-5 |
| Literature: DSM IP ASSESTS B.V. Patent: WO2003/106447 A1, 2003 ; Location in patent: Page 4 ; |
|
~10%
tert-butyl 2-[(... CAS#:154026-94-5 |
| Literature: Wolberg, Michael; Hummel, Werner; Mueller, Michael Chemistry - A European Journal, 2001 , vol. 7, # 21 p. 4562 - 4571 |
|
~65%
tert-butyl 2-[(... CAS#:154026-94-5 |
| Literature: Bode, Silke E.; Muller, Michael; Wolberg, Michael Organic Letters, 2002 , vol. 4, # 4 p. 619 - 621 |
|
~%
tert-butyl 2-[(... CAS#:154026-94-5 |
| Literature: Chemistry - A European Journal, , vol. 7, # 21 p. 4562 - 4571 |
|
~%
tert-butyl 2-[(... CAS#:154026-94-5 |
| Literature: Chemistry - A European Journal, , vol. 7, # 21 p. 4562 - 4571 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 6 | |
|---|---|
| DownStream 3 | |
![tert-Butyl 6-[(1E)-2-[4-(4-fluorophenyl)-6-(1-methylethyl)-2-[methyl(methylsulfonyl)amino]-5-pyrimidinyl]ethenyl]-2,2-dimethyl-1,3-dioxane-4-acetate structure](https://image.chemsrc.com/caspic/152/289042-12-2.png)
CAS#:289042-12-2
CAS#:125971-94-0![(4R-Cis)-6-[(acetyloxy)methyl]-2,2-dimethyl-1,3-dioxane-4-aceticacid,1,1-dimethylethylester structure](https://image.chemsrc.com/caspic/206/154026-95-6.png)
CAS#:154026-95-6This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Tert-butyl[(4R,6R)-6-chloromethyl-1,3-dioxan-4-yl]acetate |
| 2-Methyl-2-propanyl [(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate |
| tert-Butyl [(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate |
| tert-butyl syn-(3R,5S)-6-chloro-3,5-(isopropylidenedioxy)-hexanoate |
| (4R-cis)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxane-4-acetic acid |
| X6301 |
| (4R-cis)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxane-4-acetic acid,1,1-dimethylethyl ester |
| t-butyl (4R-cis)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-ylacetate |
| 1,3-Dioxane-4-aceticacid,6-(chloromethyl)-2,2-dimethyl-,1,1-dimethylethyl ester,(4R,6S) |
| ((4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl)acetic acid tert-butyl ester |
| 1,1-dimethylethyl (4R,6S)-6-chloromethyl-2,2,-dimethyl-1,3-dioxane-4-acetate |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the SMILES notation of tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate? |
| A: SMILES notation of tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate is CC(C)(C)OC(=O)CC1CC(CCl)OC(C)(C)O1. |
| Q: What is the English name of tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate? |
| A: The English name of tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate is tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate. |
| Q: What are the downstream products of tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate? |
| A: Related downstream products(CAS) of tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate: 289042-12-2;125971-94-0;154026-95-6. |
| Q: What are the upstream materials of tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate? |
| A: Related upstream materials(CAS) of tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate: 391218-18-1;75-65-0;77-76-9;154026-93-4;1694-31-1;154026-92-3. |
| Q: What is the boiling point of tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate? |
| A: Boiling point of tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate is 326.2±22.0 °C at 760 mmHg. |
| Q: What is the InChIKey of tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate? |
| A: InChIKey of tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate is TXLXWCARAPIXGH-ZJUUUORDSA-N. |
| Q: What is the LogP of tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate? |
| A: LogP of tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate is 2.56. |
| Q: What is the molecular formula of tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate? |
| A: Molecular formula of tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate is C13H23ClO4. |
| Q: What is the molecular weight of tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate? |
| A: Molecular weight of tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate is 278.772. |
| Q: What is the polar surface area (PSA) of tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate? |
| A: Polar surface area (PSA) of tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate is 44.76000. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Henan Tianfu Chemical Co., Ltd. |