1-(1-Ethoxyethoxy)propane
Basic information
- CAS
20680-10-8- Standard SMILES
CCCOC(C)OCC- InChIKey
XKPTXCDASJWOLK-UHFFFAOYSA-N- Molecular formula
- C7H16O2
- Average molar mass
- 132.2 g/mol
- Monoisotopic mass
- 132.11502975
Names & identifiers
- Preferred name
- 1-(1-Ethoxyethoxy)propane
- IUPAC
- 1-(1-ethoxyethoxy)propane
- English name
- 1-(1-ethoxyethoxy)propane
- Molecular formula
- C7H16O2
- Molecular weight
- 132.2
Names & synonyms
1-(1-Ethoxyethoxy)propane20680-10-81-ETHOXY-1-PROPOXYETHANEPropane, 1-(1-ethoxyethoxy)-Acetaldehyde ethyl propyl acetalAcetaldehyde, ethyl propyl acetalR57Y77S7R5EINECS 243-963-4ETHYL PROPYL ACETALAI3-38086DTXSID30864955ETHANE, 1-ETHOXY-1-PROPOXY-
Show more names
Acetaldehyde ethylpropyl acetal
RefChem:419727DTXCID00813415243-963-41?-?(1-Ethoxyethoxy)?propaneEthane, 1-ethoxy-1-propoxy1-(1-Ethoxyethoxy) PropaneSCHEMBL261533UNII-R57Y77S7R5
Database identifiers
- CAS
20680-10-8- PubChem CID
- 30220
- DTXSID
DTXSID30864955- UNII
- R57Y77S7R5
- EC Number
- 243-963-4
- Nikkaji
- J100.453K
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 54.9
Experimental & physicochemical properties
Flavoring AgentsEU Flavoring substances
Physicochemical properties
- Boiling point
- 53 · 53-55 °C(Press: 35 Torr)
- Density
- 0.8374 g/cm3 · 0.8374 g/cm3
- FLAVIS Number
- 6.086 · 06.086 | 1-Ethoxy-1-propoxyethane
- LogP
- 1.531 · 1.531 (est)
- FDA UNII
- 57 Y77S7R5 · R57Y77S7R5
- EPA Substance Registry System
- 1 · Propane, 1-(1-ethoxyethoxy)- (20680-10-8)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory Information
Chemical: Propane, 1-(1-ethoxyethoxy)-
Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)
Propane, 1-(1-ethoxyethoxy)-: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPropane, 1-(1-ethoxyethoxy)-: INACTIVE
Applications
Uses1-(1-Ethoxyethoxy)propane is a flavor and fragrance agent found in different aging stages of food and alcohol production.
Upstream & downstream products
Downstream products
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Related reactions
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Compound notes
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