Basic information
- Standard SMILES
C#CCOC(=O)/C=C\[C@H]1[C@@H](C(=O)OC(C)(C)C)C1(C)C- InChIKey
QEIBIPRZLSVRMJ-HRPRIBIWSA-N- Molecular formula
- C16H22O4
- Average molar mass
- 278.34 g/mol
Names & identifiers
- Preferred name
- tert.-butyl(1R,cis)2,2-dimethyl-3-[Z-2-(propargyloxy-carbonyl)-ethenyl]cyclopropane-carboxylate
- IUPAC
- trans-tert-butyl (1R,3S)-2,2-dimethyl-3-[(Z)-3-oxo-3-prop-2-ynoxyprop-1-enyl]cyclopropane-1-carboxylate
Names & synonyms
QEIBIPRZLSVRMJ-HRPRIBIWSA-Ntert.-butyl (1R,cis) 2,2-dimethyl-3-[Z-2-(propargyloxy-carbonyl)-ethenyl]-cyclopropane-carboxylatetert.-butyl(1R,cis)2,2-dimethyl-3-[Z-2-(propargyloxy-carbonyl)-ethenyl]cyclopropane-carboxylate
Database identifiers
- PubChem CID
- 86739014
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 470
Related reactions
4 records
Compound notes
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