methyl 2-acetyl-3-methoxybut-2-enoate
methyl 2-acetyl-3-methoxybut-2-enoate structure
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Common Name | methyl 2-acetyl-3-methoxybut-2-enoate | ||
|---|---|---|---|---|
| CAS Number | 80751-03-7 | Molecular Weight | 172.17800 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C8H12O4 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | methyl 2-acetyl-3-methoxybut-2-enoate |
|---|---|
| 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 | C8H12O4 |
|---|---|
| Molecular Weight | 172.17800 |
| Exact Mass | 172.07400 |
| PSA | 52.60000 |
| LogP | 0.66880 |
| InChIKey | CPXBIWUHSXPDLL-VOTSOKGWSA-N |
| SMILES | COC(=O)C(C(C)=O)=C(C)OC |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~61%
methyl 2-acetyl... CAS#:80751-03-7 |
| Literature: Emelina, E. E.; Ermakov, N. V.; Ershov, B. A. Russian Journal of General Chemistry, 1994 , vol. 64, # 1.2 p. 123 - 124 Zhurnal Obshchei Khimii, 1994 , vol. 64, # 1 p. 133 - 134 |
|
~66%
methyl 2-acetyl... CAS#:80751-03-7 |
| Literature: Cameron, Donald W.; Deutscher, D. Jeanne; Feutrill, Geoffrey I.; Griffiths, Peter G. Australian Journal of Chemistry, 1981 , vol. 34, # 11 p. 2401 - 2421 |
|
~%
methyl 2-acetyl... CAS#:80751-03-7 |
| Literature: Roberge,G.; Brassard,P. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1978 , p. 1041 - 1046 |
|
~%
methyl 2-acetyl... CAS#:80751-03-7 |
| Literature: Tyman, John; Ghorbanian, Shoreh; Muir, M.; Tychopoulous, Vasiliki; Bruce, Ian; Fisher, Ian Synthetic Communications, 1989 , vol. 19, # 1, 2 p. 179 - 188 |
|
~%
methyl 2-acetyl... CAS#:80751-03-7 |
| Literature: Lemoine, Remy C.; Petersen, Ann C.; Setti, Lina; Wanner, Jutta; Jekle, Andreas; Heilek, Gabrielle; deRosier, Andre; Ji, Changhua; Berry, Pamela; Rotstein, David Bioorganic and Medicinal Chemistry Letters, 2010 , vol. 20, # 2 p. 704 - 708 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 6 | |
|---|---|
| DownStream 2 | |
CAS#:73773-25-8
CAS#:832090-45-6This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| methyl 2-acetyl-3-methoxy-2-butenoate |
| 4-Methoxy-3-methoxycarbonyl-3-methylpentan-2,4-dion |
| 2-acetyl-3-methoxy-but-2-enoic acid methyl ester |
| 2-Butenoic acid,2-acetyl-3-methoxy-,methyl ester |
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 methyl 2-acetyl-3-methoxybut-2-enoate? |
| A: Related upstream materials(CAS) of methyl 2-acetyl-3-methoxybut-2-enoate: 1445-45-0;105-45-3;922-69-0;4619-66-3;77-78-1;333-27-7. |
| Q: What is the SMILES notation of methyl 2-acetyl-3-methoxybut-2-enoate? |
| A: SMILES notation of methyl 2-acetyl-3-methoxybut-2-enoate is COC(=O)C(C(C)=O)=C(C)OC. |
| Q: What is the Chinese name of 80751-03-7? |
| A: Chinese name of 80751-03-7 is 80751-03-7. |
| Q: What is the molecular weight of methyl 2-acetyl-3-methoxybut-2-enoate? |
| A: Molecular weight of methyl 2-acetyl-3-methoxybut-2-enoate is 172.17800. |
| Q: What is the InChIKey of methyl 2-acetyl-3-methoxybut-2-enoate? |
| A: InChIKey of methyl 2-acetyl-3-methoxybut-2-enoate is CPXBIWUHSXPDLL-VOTSOKGWSA-N. |
| Q: What English synonyms does methyl 2-acetyl-3-methoxybut-2-enoate have? |
| A: English synonyms of methyl 2-acetyl-3-methoxybut-2-enoate: methyl 2-acetyl-3-methoxy-2-butenoate, 4-Methoxy-3-methoxycarbonyl-3-methylpentan-2,4-dion, 2-acetyl-3-methoxy-but-2-enoic acid methyl ester, 2-Butenoic acid,2-acetyl-3-methoxy-,methyl ester. |
| Q: What is the molecular formula of methyl 2-acetyl-3-methoxybut-2-enoate? |
| A: Molecular formula of methyl 2-acetyl-3-methoxybut-2-enoate is C8H12O4. |
| Q: What is the polar surface area (PSA) of methyl 2-acetyl-3-methoxybut-2-enoate? |
| A: Polar surface area (PSA) of methyl 2-acetyl-3-methoxybut-2-enoate is 52.60000. |
| Q: What is the LogP of methyl 2-acetyl-3-methoxybut-2-enoate? |
| A: LogP of methyl 2-acetyl-3-methoxybut-2-enoate is 0.66880. |
| Q: What is the CAS number of methyl 2-acetyl-3-methoxybut-2-enoate? |
| A: CAS number of methyl 2-acetyl-3-methoxybut-2-enoate is 80751-03-7. |