cis-2-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolane-4-methanol
cis-2-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolane-4-methanol structure
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Common Name | cis-2-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolane-4-methanol | ||
|---|---|---|---|---|
| CAS Number | 61397-58-8 | Molecular Weight | 329.17900 | |
| Density | 1.48g/cm3 | Boiling Point | 529.1ºC at 760 mmHg | |
| Molecular Formula | C14H14Cl2N2O3 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 273.8ºC | |
Summary: ketoconazole intermediate, also known as cis-2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolane-4-methanol, with CAS number 61397-58-8, has a molecular formula of C14H14Cl2N2O3. 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 | ketoconazole intermediate |
|---|---|
| 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 | 1.48g/cm3 |
|---|---|
| Boiling Point | 529.1ºC at 760 mmHg |
| Molecular Formula | C14H14Cl2N2O3 |
| Molecular Weight | 329.17900 |
| Flash Point | 273.8ºC |
| Exact Mass | 328.03800 |
| PSA | 56.51000 |
| LogP | 2.45060 |
| Index of Refraction | 1.637 |
| InChIKey | VJZJGRMLFMJRGG-IAXJKZSUSA-N |
| SMILES | OCC1COC(Cn2ccnc2)(c2ccc(Cl)cc2Cl)O1 |
| Storage condition | 2-8°C |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~96%
cis-2-(2,4-Dich... CAS#:61397-58-8 |
| Literature: Baji; Kimny, Tan; Gasquez; Flammang; Compagnon; Delcourt; Mathieu; Viossat; Morgant; Nguyen-Huy European Journal of Medicinal Chemistry, 1997 , vol. 32, # 7-8 p. 637 - 650 |
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~96%
cis-2-(2,4-Dich... CAS#:61397-58-8 |
| Literature: Chapman, David R.; Bauer, Ludwig Journal of Heterocyclic Chemistry, 1990 , vol. 27, # 7 p. 2053 - 2061 |
|
~%
cis-2-(2,4-Dich... CAS#:61397-58-8 |
| Literature: European Journal of Medicinal Chemistry, , vol. 32, # 7-8 p. 637 - 650 |
|
~%
cis-2-(2,4-Dich... CAS#:61397-58-8 |
| Literature: European Journal of Medicinal Chemistry, , vol. 32, # 7-8 p. 637 - 650 |
|
~%
cis-2-(2,4-Dich... CAS#:61397-58-8 |
| Literature: European Journal of Medicinal Chemistry, , vol. 32, # 7-8 p. 637 - 650 |
|
~%
cis-2-(2,4-Dich... CAS#:61397-58-8 |
| Literature: European Journal of Medicinal Chemistry, , vol. 32, # 7-8 p. 637 - 650 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 5 | |
|---|---|
| DownStream 1 | |
CAS#:61397-61-3This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| cis-1-tert-Butyl-3-methylcyclopentane |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What are the upstream materials of ketoconazole intermediate? |
| A: Related upstream materials(CAS) of ketoconazole intermediate: 70894-66-5;83086-42-4;68751-57-5;61397-56-6;2234-16-4. |
| Q: What is the molecular weight of ketoconazole intermediate? |
| A: Molecular weight of ketoconazole intermediate is 329.17900. |
| Q: What is the CAS number of ketoconazole intermediate? |
| A: CAS number of ketoconazole intermediate is 61397-58-8. |
| Q: What is the SMILES notation of ketoconazole intermediate? |
| A: SMILES notation of ketoconazole intermediate is OCC1COC(Cn2ccnc2)(c2ccc(Cl)cc2Cl)O1. |
| Q: What is the molecular formula of ketoconazole intermediate? |
| A: Molecular formula of ketoconazole intermediate is C14H14Cl2N2O3. |
| Q: What is the polar surface area (PSA) of ketoconazole intermediate? |
| A: Polar surface area (PSA) of ketoconazole intermediate is 56.51000. |
| Q: What is the LogP of ketoconazole intermediate? |
| A: LogP of ketoconazole intermediate is 2.45060. |
| Q: What are the storage conditions for ketoconazole intermediate? |
| A: Storage conditions for ketoconazole intermediate: 2-8°C. |
| Q: What is the English name of ketoconazole intermediate? |
| A: The English name of ketoconazole intermediate is ketoconazole intermediate. |
| Q: What is the boiling point of ketoconazole intermediate? |
| A: Boiling point of ketoconazole intermediate is 529.1ºC at 760 mmHg. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |