5-(Chloromethyl)-3-methyl-1,2-oxazole
5-(Chloromethyl)-3-methyl-1,2-oxazole structure
|
Common Name | 5-(Chloromethyl)-3-methyl-1,2-oxazole | ||
|---|---|---|---|---|
| CAS Number | 40340-41-8 | Molecular Weight | 131.560 | |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 211.6±25.0 °C at 760 mmHg | |
| Molecular Formula | C5H6ClNO | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 81.8±23.2 °C | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 5-(Chloromethyl)-3-methylisoxazole |
|---|---|
| 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 | 211.6±25.0 °C at 760 mmHg |
| Molecular Formula | C5H6ClNO |
| Molecular Weight | 131.560 |
| Flash Point | 81.8±23.2 °C |
| Exact Mass | 131.013794 |
| PSA | 26.03000 |
| LogP | 0.81 |
| Vapour Pressure | 0.3±0.4 mmHg at 25°C |
| Index of Refraction | 1.483 |
| InChIKey | ZWBJJNWJUXXFNP-UHFFFAOYSA-N |
| SMILES | Cc1cc(CCl)on1 |
| Storage condition | 2-8°C |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2934999090 |
|---|
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~45%
5-(Chloromethyl... CAS#:40340-41-8 |
| Literature: Li, Wen-Tai; Hwang, Der-Ren; Chen, Ching-Ping; Shen, Chien-Wei; Huang, Chen-Long; Chen, Tung-Wei; Lin, Chi-Hung; Chang, Yee-Ling; Chang, Ying-Ying; Lo, Yue-Kan; Tseng, Huan-Yi; Lin, Chu-Chung; Song, Jeng-Shin; Chen, Hua-Chien; Chen, Shu-Jen; Wu, Se-Hui; Chen, Chiung-Tong Journal of Medicinal Chemistry, 2003 , vol. 46, # 9 p. 1706 - 1715 |
|
~%
5-(Chloromethyl... CAS#:40340-41-8 |
| Literature: Ibragimov,I.I. et al. Chemistry of Heterocyclic Compounds (New York, NY, United States), 1977 , vol. 13, p. 1033 Khimiya Geterotsiklicheskikh Soedinenii, 1977 , vol. 13, p. 1278 |
|
~%
5-(Chloromethyl... CAS#:40340-41-8 |
| Literature: Stagno d'Alcontres; Cuzzocrea Atti della Societa Peloritana di Scienze Fisiche, Matematiche e Naturali, 1957 , vol. 3, p. 179,185 |
|
~%
5-(Chloromethyl... CAS#:40340-41-8 |
| Literature: Stagno d'Alcontres; Cuzzocrea Atti della Societa Peloritana di Scienze Fisiche, Matematiche e Naturali, 1957 , vol. 3, p. 179,185 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 4 | |
|---|---|
| DownStream 3 | |
CAS#:13999-31-0
CAS#:43214-88-6![5-[(1-Indolyl)Methyl]-3-Methylisoxazole structure](https://image.chemsrc.com/caspic/201/528593-71-7.png)
CAS#:528593-71-7This 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 collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 5-(Chloromethyl)-3-methyl-1,2-oxazole |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What English synonyms does 5-(Chloromethyl)-3-methylisoxazole have? |
| A: English synonyms of 5-(Chloromethyl)-3-methylisoxazole: 5-(Chloromethyl)-3-methyl-1,2-oxazole. |
| Q: What is the molecular formula of 5-(Chloromethyl)-3-methylisoxazole? |
| A: Molecular formula of 5-(Chloromethyl)-3-methylisoxazole is C5H6ClNO. |
| Q: What is the LogP of 5-(Chloromethyl)-3-methylisoxazole? |
| A: LogP of 5-(Chloromethyl)-3-methylisoxazole is 0.81. |
| Q: What is the SMILES notation of 5-(Chloromethyl)-3-methylisoxazole? |
| A: SMILES notation of 5-(Chloromethyl)-3-methylisoxazole is Cc1cc(CCl)on1. |
| Q: What are the storage conditions for 5-(Chloromethyl)-3-methylisoxazole? |
| A: Storage conditions for 5-(Chloromethyl)-3-methylisoxazole: 2-8°C. |
| Q: What is the boiling point of 5-(Chloromethyl)-3-methylisoxazole? |
| A: Boiling point of 5-(Chloromethyl)-3-methylisoxazole is 211.6±25.0 °C at 760 mmHg. |
| Q: What is the InChIKey of 5-(Chloromethyl)-3-methylisoxazole? |
| A: InChIKey of 5-(Chloromethyl)-3-methylisoxazole is ZWBJJNWJUXXFNP-UHFFFAOYSA-N. |
| Q: What is the polar surface area (PSA) of 5-(Chloromethyl)-3-methylisoxazole? |
| A: Polar surface area (PSA) of 5-(Chloromethyl)-3-methylisoxazole is 26.03000. |
| Q: What is the CAS number of 5-(Chloromethyl)-3-methylisoxazole? |
| A: CAS number of 5-(Chloromethyl)-3-methylisoxazole is 40340-41-8. |
| Q: What is the molecular weight of 5-(Chloromethyl)-3-methylisoxazole? |
| A: Molecular weight of 5-(Chloromethyl)-3-methylisoxazole is 131.560. |
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. |