Acetic acid,2-cyano-2-cyclohexylidene-, ethyl ester
Acetic acid,2-cyano-2-cyclohexylidene-, ethyl ester structure
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Common Name | Acetic acid,2-cyano-2-cyclohexylidene-, ethyl ester | ||
|---|---|---|---|---|
| CAS Number | 6802-76-2 | Molecular Weight | 193.24200 | |
| Density | 1.084g/cm3 | Boiling Point | 310.4ºC at 760 mmHg | |
| Molecular Formula | C11H15NO2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 144.4ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | ethyl 2-cyano-2-cyclohexylideneacetate |
|---|---|
| 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 | 1.084g/cm3 |
|---|---|
| Boiling Point | 310.4ºC at 760 mmHg |
| Molecular Formula | C11H15NO2 |
| Molecular Weight | 193.24200 |
| Flash Point | 144.4ºC |
| Exact Mass | 193.11000 |
| PSA | 50.09000 |
| LogP | 2.33378 |
| Index of Refraction | 1.496 |
| InChIKey | PZAJJZJKRVXKCS-UHFFFAOYSA-N |
| SMILES | CCOC(=O)C(C#N)=C1CCCCC1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2926909090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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Acetic acid,2-c... CAS#:6802-76-2 |
| Literature: Krishnan, G. Rajesh; Sreekumar, Krishnapillai European Journal of Organic Chemistry, 2008 , # 28 p. 4763 - 4768 |
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Acetic acid,2-c... CAS#:6802-76-2 |
| Literature: Journal of the Chemical Society, , p. 2148 |
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Acetic acid,2-c... CAS#:6802-76-2 |
| Literature: Journal of the Chemical Society, , p. 2148 |
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Acetic acid,2-c... CAS#:6802-76-2 |
| Literature: Scientia Pharmaceutica, , vol. 43, p. 183,184, 188 |
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| Literature: Journal of the American Chemical Society, , vol. 59, p. 2327,2329 |
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| Literature: Journal of the American Chemical Society, , vol. 63, p. 3455 |
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| Literature: Journal of the American Chemical Society, , vol. 71, p. 989,991 |
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| Literature: Journal of the Chemical Society, , vol. 93, p. 1944,1945,1956 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 10 | |
|---|---|
| DownStream 10 | |
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CAS#:4506-71-2
CAS#:52-31-3
CAS#:67950-95-2![2-oxaspiro[4.5]decane-1,3-dione structure](https://image.chemsrc.com/caspic/081/6051-25-8.png)
CAS#:6051-25-8
CAS#:5292-21-7
CAS#:6975-71-9
CAS#:128262-20-4This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2926909090 |
|---|---|
| Summary | HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
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Name: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| EINECS 229-878-5 |
| Cyclohexylidenecyanoacetic acid ethyl ester |
| ethyl cyano(cyclohexylidene)acetate |
| ethyl 2-cyano-2-cyclohexylidineacetate |
| Acetic acid,2-cyano-2-cyclohexylidene-,ethyl ester |
| ethyl cyclohexylidenecyanoacetate |
| cyano-cyclohexyliden-acetic acid ethyl ester |
| 2-Cyano-2-cyclohexylideneacetic acid ethyl ester |
| Cyan-cyclohexyliden-essigsaeure-aethylester |
| ethyl-2-cyano-2-cyclohexylideneacetate |
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 ethyl 2-cyano-2-cyclohexylideneacetate? |
| A: Related upstream materials(CAS) of ethyl 2-cyano-2-cyclohexylideneacetate: 108-94-1;105-56-6;64-17-5;37107-50-9;60-35-5;64-19-7;631-61-8;71-43-2;1502-22-3;141-52-6. |
| Q: What English synonyms does ethyl 2-cyano-2-cyclohexylideneacetate have? |
| A: English synonyms of ethyl 2-cyano-2-cyclohexylideneacetate: EINECS 229-878-5, Cyclohexylidenecyanoacetic acid ethyl ester, ethyl cyano(cyclohexylidene)acetate, ethyl 2-cyano-2-cyclohexylidineacetate, Acetic acid,2-cyano-2-cyclohexylidene-,ethyl ester, ethyl cyclohexylidenecyanoacetate, cyano-cyclohexyliden-acetic acid ethyl ester, 2-Cyano-2-cyclohexylideneacetic acid ethyl ester, Cyan-cyclohexyliden-essigsaeure-aethylester, ethyl-2-cyano-2-cyclohexylideneacetate. |
| Q: What is the boiling point of ethyl 2-cyano-2-cyclohexylideneacetate? |
| A: Boiling point of ethyl 2-cyano-2-cyclohexylideneacetate is 310.4ºC at 760 mmHg. |
| Q: What is the CAS number of ethyl 2-cyano-2-cyclohexylideneacetate? |
| A: CAS number of ethyl 2-cyano-2-cyclohexylideneacetate is 6802-76-2. |
| Q: What is the molecular formula of ethyl 2-cyano-2-cyclohexylideneacetate? |
| A: Molecular formula of ethyl 2-cyano-2-cyclohexylideneacetate is C11H15NO2. |
| Q: What is the Chinese name of 6802-76-2? |
| A: Chinese name of 6802-76-2 is 6802-76-2. |
| Q: What is the LogP of ethyl 2-cyano-2-cyclohexylideneacetate? |
| A: LogP of ethyl 2-cyano-2-cyclohexylideneacetate is 2.33378. |
| Q: What is the InChIKey of ethyl 2-cyano-2-cyclohexylideneacetate? |
| A: InChIKey of ethyl 2-cyano-2-cyclohexylideneacetate is PZAJJZJKRVXKCS-UHFFFAOYSA-N. |
| Q: What is the molecular weight of ethyl 2-cyano-2-cyclohexylideneacetate? |
| A: Molecular weight of ethyl 2-cyano-2-cyclohexylideneacetate is 193.24200. |
| Q: What is the SMILES notation of ethyl 2-cyano-2-cyclohexylideneacetate? |
| A: SMILES notation of ethyl 2-cyano-2-cyclohexylideneacetate is CCOC(=O)C(C#N)=C1CCCCC1. |
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. |