Prop-2-yn-1-yl furan-2-carboxylate
Basic information
- CAS
83133-06-6- Standard SMILES
C#CCOC(=O)c1ccco1- InChIKey
KURJAKWCBGPFNA-UHFFFAOYSA-N- Molecular formula
- C8H6O3
- Average molar mass
- 150.13 g/mol
- Monoisotopic mass
- 150.03169405
Names & identifiers
- Preferred name
- Prop-2-yn-1-yl furan-2-carboxylate
- IUPAC
- prop-2-ynyl furan-2-carboxylate
- English name
- 2-Furancarboxylicacid,2-propynylester(9CI)
- Molecular formula
- C8H6O3
- Molecular weight
- 150.13
Names & synonyms
Prop-2-yn-1-yl furan-2-carboxylate83133-06-6DTXSID90469783RefChem:373895DTXCID80420601propargyl 2-furoateSCHEMBL154192772-Furancarboxylicacid,2-propynylester(9CI)2-Furancarboxylic acid, 2-propyn-1-yl ester
Database identifiers
- CAS
83133-06-6- PubChem CID
- 11636827
- DTXSID
DTXSID90469783- Nikkaji
- J1.960.732A
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 39.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 189
Physicochemical properties
- Boiling point
- 239.9 · 239.9±20.0 °C(Predicted)
- Density
- 1.183 · 1.183±0.06 g/cm3(Predicted)
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…