Diethyl[2-(prop-2-yn-1-yloxy)ethyl]propanedioate
Basic information
- CAS
38858-63-8- Standard SMILES
C#CCOCCC(C(=O)OCC)C(=O)OCC- InChIKey
AXNHHJGTSWDGKP-UHFFFAOYSA-N- Molecular formula
- C12H18O5
- Average molar mass
- 242.27 g/mol
- Monoisotopic mass
- 242.11542367
Names & identifiers
- Preferred name
- Diethyl[2-(prop-2-yn-1-yloxy)ethyl]propanedioate
- IUPAC
- diethyl 2-(2-prop-2-ynoxyethyl)propanedioate
Names & synonyms
38858-63-8diethyl[2-(prop-2-yn-1-yloxy)ethyl]propanedioateNSC148227SCHEMBL25226822DTXSID10302042NSC-148227Diethyl {2-[(prop-2-yn-1-yl)oxy]ethyl}propanedioate
Database identifiers
- CAS
38858-63-8- PubChem CID
- 287933
- DTXSID
DTXSID10302042
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 271
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…