methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate
methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate structure
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Common Name | methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate | ||
|---|---|---|---|---|
| CAS Number | 4357-94-2 | Molecular Weight | 251.66600 | |
| Density | 1.278g/cm3 | Boiling Point | 372.1ºC at 760 mmHg | |
| Molecular Formula | C12H10ClNO3 | Melting Point | 56-58ºC | |
| MSDS | N/A | Flash Point | 178.9ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate |
|---|---|
| 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 | 1.278g/cm3 |
|---|---|
| Boiling Point | 372.1ºC at 760 mmHg |
| Melting Point | 56-58ºC |
| Molecular Formula | C12H10ClNO3 |
| Molecular Weight | 251.66600 |
| Flash Point | 178.9ºC |
| Exact Mass | 251.03500 |
| PSA | 52.33000 |
| LogP | 3.09000 |
| Index of Refraction | 1.55 |
| InChIKey | XJKXWSPETWYDLS-UHFFFAOYSA-N |
| SMILES | COC(=O)c1c(-c2ccccc2Cl)noc1C |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2934999090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~%
methyl 3-(2-chl... CAS#:4357-94-2 |
| Literature: Ramana, P. Venkata; Reddy, A. Ram Journal of Heterocyclic Chemistry, 2012 , vol. 49, # 3 p. 621 - 627 |
|
~77%
methyl 3-(2-chl... CAS#:4357-94-2 |
| Literature: Perumal, Senthil K.; Adediran; Pratt Bioorganic and Medicinal Chemistry, 2008 , vol. 16, # 14 p. 6987 - 6994 |
|
~%
methyl 3-(2-chl... CAS#:4357-94-2 |
| Literature: Ramana, P. Venkata; Reddy, A. Ram Journal of Heterocyclic Chemistry, 2012 , vol. 49, # 3 p. 621 - 627 |
|
~%
methyl 3-(2-chl... CAS#:4357-94-2 |
| Literature: Ramana, P. Venkata; Reddy, A. Ram Journal of Heterocyclic Chemistry, 2012 , vol. 49, # 3 p. 621 - 627 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 6 | |
|---|---|
| DownStream 4 | |
CAS#:61-72-3
CAS#:23598-72-3![[3-(2-Chlorophenyl)-5-methyl-1,2-oxazol-4-yl]methanol structure](https://image.chemsrc.com/caspic/291/495417-33-9.png)
CAS#:495417-33-9This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2934999090 |
|---|---|
| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: HCMV UL50
External Id: HMS1262
|
|
Name: Chemical Probes of Kaposi's Sarcoma Herpes Virus Latent Infection
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: ORF 73 [Human herpesvirus 8 type M]
External Id: HMS791
|
|
Name: High-throughput screen for inhibitors of the GIV GBA-motif interaction with Galpha-i ...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS1303
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| methyl-3-(2-chlorophenyl)-5-methylisoxazol-4-carboxylate |
| methyl 3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxylate |
| 3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxylic acid,methyl ester |
| 5-Methyl-4-methoxycarbonyl-3-(2-chlor-phenyl)-isoxazol |
| 3-(2-chloro-phenyl)-5-methyl-isoxazole-4-carboxylic acid methyl ester |
| methyl 3-(2'-chlorophenyl)-5-methylisoxazole-4-carboxylate |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular weight of methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate? |
| A: Molecular weight of methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate is 251.66600. |
| Q: What is the melting point of methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate? |
| A: Melting point of methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate is 56-58ºC. |
| Q: What is the InChIKey of methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate? |
| A: InChIKey of methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate is XJKXWSPETWYDLS-UHFFFAOYSA-N. |
| Q: What is the English name of methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate? |
| A: The English name of methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate is methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate. |
| Q: What is the SMILES notation of methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate? |
| A: SMILES notation of methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate is COC(=O)c1c(-c2ccccc2Cl)noc1C. |
| Q: What is the polar surface area (PSA) of methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate? |
| A: Polar surface area (PSA) of methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate is 52.33000. |
| Q: What is the LogP of methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate? |
| A: LogP of methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate is 3.09000. |
| Q: What is the molecular formula of methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate? |
| A: Molecular formula of methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate is C12H10ClNO3. |
| Q: What are the downstream products of methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate? |
| A: Related downstream products(CAS) of methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate: 61-72-3;25629-50-9;23598-72-3;495417-33-9. |
| Q: What is the boiling point of methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate? |
| A: Boiling point of methyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate is 372.1ºC 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 |