Diazoacetic Ester
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CAS Number 623-73-4
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Catalog Number io-406814
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Molecular Weight 114.1000
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SMILES CCOC(=O)C=[N+]=[N-]
| Size | QTY | Notes | |
|---|---|---|---|
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| 1 | Ethyl diazoacetate |
| 2 | Diazoacetic ester |
| 3 | Ethyl 2-diazoacetate |
| 4 | Ethyldiazoacetate |
| 5 | DAAE |
| Molecular Formula | C4H6N2O2 |
|---|---|
| Canonical SMILES | CCOC(=O)C=[N+]=[N-] |
| Isomeric SMILES | CCOC(=O)C=[N+]=[N-] |
| Molecular Weight | 114.1000 |
| InChIKey | YVPJCJLMRRTDMQ-UHFFFAOYSA-N |
| InChI | InChI=1S/C4H6N2O2/c1-2-8-4(7)3-6-5/h3H,2H2,1H3 |
| XLogP | 0.7000 |
| ExactMass | 114.0429 |
| MonoisotopicMass | 114.0429 |
| TPSA | 28.3000 |
| Complexity | 126.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 0 |
| HBondAcceptorCount | 3 |
| RotatableBondCount | 3 |
| HeavyAtomCount | 8 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 1 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 1 |
| CovalentUnitCount | 1 |
| PatentCount | 10928 |
| PatentFamilyCount | 2735 |
| LiteratureCount | 514 |
