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| SKU | Size | Availability |
Price | Qty |
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T349700-5ml
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5ml |
3
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$76.90
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Discover trans-2-Butenal diethyl acetal by Aladdin Scientific in 95% for only $76.90. Available - in Ligands at Aladdin Scientific. Tags: .
| Synonyms | (E)-1,1-diethoxybut-2-ene | starbld0003752 | crotonaldehyde diethyl acetal | AS-76693 | NSC219876 | NSC-219876 | InChI=1/C8H16O2/c1-4-7-8(9-5-2)10-6-3/h4,7-8H,5-6H2,1-3H3/b7-4+ | (2E)-1,1-diethoxybut-2-ene | SCHEMBL2025292 | 1,1-Diethoxybut-2-ene | trans- |
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| Specifications & Purity | ≥95% |
| Shipped In | Normal |
| Product Description |
trans-2-Butenal diethyl acetal is an acetal. Acetals are usually derived from the aldehydes. They have two single-bonded oxygen atoms attached to the same carbon atom. They are stable under basic conditions and they can be hydrolyzed back to the carbonyl compound. Acetals serves as a carbonyl protecting group and also are present as functional groups in glycosidic bonds. trans-2-Butenal diethyl acetal has been synthesized from trans-2-butenal with ethanol in the presence of methanesulfonic acid or methylsulfonate as catalysts. Application: trans-2-Butenal diethyl acetal may be used in the preparation of 2S,3S-epoxybutan-1-ol, an intermediate in the synthesis of erythromycin antibiotic.
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Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organic oxygen compounds |
| Class | Organooxygen compounds |
| Subclass | Ethers |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Acetals |
| Alternative Parents | Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Acetal - Hydrocarbon derivative - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as acetals. These are compounds having the structure R2C(OR')2 ( R' not Hydrogen) and thus diethers of geminal diols. Originally, the term was confined to derivatives of aldehydes (one R = H), but it now applies equally to derivatives of ketones (neither R = H ). Mixed acetals have different R' groups. |
| External Descriptors | Not available |
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| IUPAC Name | (E)-1,1-diethoxybut-2-ene |
|---|---|
| INCHI | InChI=1S/C8H16O2/c1-4-7-8(9-5-2)10-6-3/h4,7-8H,5-6H2,1-3H3/b7-4+ |
| InChIKey | ZUMISMXLQDKQDS-QPJJXVBHSA-N |
| Smiles | CCOC(C=CC)OCC |
| Isomeric SMILES | CCOC(/C=C/C)OCC |
| PubChem CID | 6278424 |
| Molecular Weight | 144.21 |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
| Certificate of Analysis | Dec 08, 2023 | T349700 |
| Refractive Index | n20/D 1.412 (lit.) |
|---|---|
| Boil Point(°C) | 146-150 °C (lit.) |
| Molecular Weight | 144.210 g/mol |
| XLogP3 | 1.700 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 5 |
| Exact Mass | 144.115 Da |
| Monoisotopic Mass | 144.115 Da |
| Topological Polar Surface Area | 18.500 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 83.300 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 1 |
| Covalently-Bonded Unit Count | 1 |