Basic information
- CAS
14273-06-4- Standard SMILES
CC#COCC- InChIKey
AEENFMCEQQAULS-UHFFFAOYSA-N- Molecular formula
- C5H8O
- Average molar mass
- 84.12 g/mol
- Monoisotopic mass
- 84.05751488
Names & identifiers
- Preferred name
- 1-Ethoxyprop-1-yne
- IUPAC
- 1-ethoxyprop-1-yne
- English name
- 1-Propynylethyl ether
- Molecular weight
- 0
Names & synonyms
1-ethoxyprop-1-yne1-ethoxy-propyne14273-06-41-Propynylethyl ether1-ethoxypropyne1-propyne, 1-ethoxy-SCHEMBL2874785SCHEMBL3034040SCHEMBL3034044SCHEMBL14721076SCHEMBL14877297DTXSID50348727
Show more names
1-Ethoxy-1-propyne
AEENFMCEQQAULS-UHFFFAOYSA-NAKOS006274572InChI=1/C5H8O/c1-3-5-6-4-2/h4H2,1-2H
Database identifiers
- CAS
14273-06-4- PubChem CID
- 640369
- DTXSID
DTXSID50348727- Nikkaji
- J441.093I
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 72.4
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Physicochemical properties
- Boiling point
- 84 °C · 84°C (estimate)
- Density
- 0.8276 · 0.8276
- refractive index
- 1.4039 · 1.4039
Related reactions
1 records
Compound notes
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