5-(Chloromethyl)isoxazole
5-(Chloromethyl)isoxazole structure
|
Common Name | 5-(Chloromethyl)isoxazole | ||
|---|---|---|---|---|
| CAS Number | 57777-33-0 | Molecular Weight | 117.53400 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C4H4ClNO | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
Summary: 5-(Chloromethyl)isoxazole (Chinese name: 5-(氯甲基)异噁唑, CAS number: 57777-33-0) is a chemical compound with molecular formula C4H4ClNO and molecular weight 117.53400. 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 | 5-(Chloromethyl)isoxazole |
|---|---|
| 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.
| Molecular Formula | C4H4ClNO |
|---|---|
| Molecular Weight | 117.53400 |
| Exact Mass | 116.99800 |
| PSA | 26.03000 |
| LogP | 1.41340 |
| InChIKey | OGCMYKGUHKUPCM-UHFFFAOYSA-N |
| SMILES | ClCc1ccno1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~%
5-(Chloromethyl... CAS#:57777-33-0 |
| 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 |
|
~82%
5-(Chloromethyl... CAS#:57777-33-0 |
| Literature: Dannhardt; Kiefer; Lambrecht; Laufer; Mutschler; Schweiger; Striegel European Journal of Medicinal Chemistry, 1995 , vol. 30, # 11 p. 839 - 850 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
|---|---|
| DownStream 0 | |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 5-(chloromethyl)-1,2-oxazole |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular formula of 5-(Chloromethyl)isoxazole? |
| A: Molecular formula of 5-(Chloromethyl)isoxazole is C4H4ClNO. |
| Q: What English synonyms does 5-(Chloromethyl)isoxazole have? |
| A: English synonyms of 5-(Chloromethyl)isoxazole: 5-(chloromethyl)-1,2-oxazole. |
| Q: What is the LogP of 5-(Chloromethyl)isoxazole? |
| A: LogP of 5-(Chloromethyl)isoxazole is 1.41340. |
| Q: What is the InChIKey of 5-(Chloromethyl)isoxazole? |
| A: InChIKey of 5-(Chloromethyl)isoxazole is OGCMYKGUHKUPCM-UHFFFAOYSA-N. |
| Q: What are the upstream materials of 5-(Chloromethyl)isoxazole? |
| A: Related upstream materials(CAS) of 5-(Chloromethyl)isoxazole: 75-17-2;624-65-7;98019-60-4. |
| Q: What is the polar surface area (PSA) of 5-(Chloromethyl)isoxazole? |
| A: Polar surface area (PSA) of 5-(Chloromethyl)isoxazole is 26.03000. |
| Q: What is the molecular weight of 5-(Chloromethyl)isoxazole? |
| A: Molecular weight of 5-(Chloromethyl)isoxazole is 117.53400. |
| Q: What is the SMILES notation of 5-(Chloromethyl)isoxazole? |
| A: SMILES notation of 5-(Chloromethyl)isoxazole is ClCc1ccno1. |
| Q: What is the CAS number of 5-(Chloromethyl)isoxazole? |
| A: CAS number of 5-(Chloromethyl)isoxazole is 57777-33-0. |
| Q: What is the English name of 5-(Chloromethyl)isoxazole? |
| A: The English name of 5-(Chloromethyl)isoxazole is 5-(Chloromethyl)isoxazole. |
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. |