3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione
3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione structure
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Common Name | 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione | ||
|---|---|---|---|---|
| CAS Number | 69009-33-2 | Molecular Weight | 222.62400 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C11H7ClO3 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
Summary: 3-Chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione, CAS号69009-33-2, molecular formula C11H7ClO3, molecular weight 222.62400, 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 | 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione |
|---|
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Molecular Formula | C11H7ClO3 |
|---|---|
| Molecular Weight | 222.62400 |
| Exact Mass | 222.00800 |
| PSA | 43.37000 |
| LogP | 1.79690 |
| InChIKey | XFTUGNYHMOMVDH-UHFFFAOYSA-N |
| SMILES | COc1ccc(-c2c(Cl)c(=O)c2=O)cc1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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3-chloro-4-(4-m... CAS#:69009-33-2 |
| Literature: Xie, Jian; Comeau, Anthony B.; Seto, Christopher T. Organic Letters, 2004 , vol. 6, # 1 p. 83 - 86 |
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~10%
3-chloro-4-(4-m... CAS#:69009-33-2 |
| Literature: Aguilar-Aguilar, Angelica; Pena-Cabrera, Eduardo Organic Letters, 2007 , vol. 9, # 21 p. 4163 - 4166 |
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~65%
3-chloro-4-(4-m... CAS#:69009-33-2 |
| Literature: Schmidt, Arthur H.; Kircher, Gunnar; Maus, Stephan; Bach, Heinz Journal of Organic Chemistry, 1996 , vol. 61, # 6 p. 2085 - 2094 |
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3-chloro-4-(4-m... CAS#:69009-33-2 |
| Literature: Bellus,D. Journal of the American Chemical Society, 1978 , vol. 100, # 25 p. 8026 - 8028 |
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3-chloro-4-(4-m... CAS#:69009-33-2 |
| Literature: Bellus,D. Journal of the American Chemical Society, 1978 , vol. 100, # 25 p. 8026 - 8028 |
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~%
3-chloro-4-(4-m... CAS#:69009-33-2 |
| Literature: Schmidt, Arthur H.; Kircher, Gunnar; Maus, Stephan; Bach, Heinz Journal of Organic Chemistry, 1996 , vol. 61, # 6 p. 2085 - 2094 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 4 | |
|---|---|
| DownStream 0 | |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the CAS number of 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione? |
| A: CAS number of 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione is 69009-33-2. |
| Q: What are the upstream materials of 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione? |
| A: Related upstream materials(CAS) of 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione: 2892-63-9;100-66-3;70744-47-7;4693-91-8. |
| Q: What is the SMILES notation of 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione? |
| A: SMILES notation of 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione is COc1ccc(-c2c(Cl)c(=O)c2=O)cc1. |
| Q: What is the English name of 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione? |
| A: The English name of 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione is 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione. |
| Q: What is the molecular weight of 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione? |
| A: Molecular weight of 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione is 222.62400. |
| Q: What is the LogP of 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione? |
| A: LogP of 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione is 1.79690. |
| Q: What is the InChIKey of 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione? |
| A: InChIKey of 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione is XFTUGNYHMOMVDH-UHFFFAOYSA-N. |
| Q: What is the Chinese name of 69009-33-2? |
| A: Chinese name of 69009-33-2 is 69009-33-2. |
| Q: What is the polar surface area (PSA) of 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione? |
| A: Polar surface area (PSA) of 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione is 43.37000. |
| Q: What is the molecular formula of 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione? |
| A: Molecular formula of 3-chloro-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione is C11H7ClO3. |