Basic information
- CAS
19060-08-3- Standard SMILES
CCOC=CC=O- InChIKey
SYIPIVAOEFWMBA-UHFFFAOYSA-N- Molecular formula
- C5H8O2
- Average molar mass
- 100.12 g/mol
- Monoisotopic mass
- 100.05242949
Names & identifiers
- Preferred name
- 3-Ethoxyprop-2-enal
- IUPAC
- 3-ethoxyprop-2-enal
- English name
- beta-ethoxyacrolein
- Molecular formula
- C5H8O2
- Molecular weight
- 100.12
Names & synonyms
3-ETHOXYPROP-2-ENAL2-Propenal, 3-ethoxy-764-63-619060-08-3SCHEMBL166077SCHEMBL2982580DTXSID90274874DB-0829123-Ethoxyacrylaldehyde3-Ethoxyacroleinbeta-ethoxyacrolein
Database identifiers
- CAS
19060-08-3、764-63-6- PubChem CID
- 29397
- DTXSID
DTXSID90274874
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 66.5
Physicochemical properties
- Boiling point
- 77 · 77-81 °C(Press: 14 Torr)
- Density
- 0.9835 g/cm3 · 0.9835 g/cm3
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers3 total
韶远科技(上海)有限公司4000665055 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 +86-17392587031 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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