2,2-Diethoxyethanol
Properties
- Molecular formula
- C6H14O3
- Molar mass
- 134.18 g/mol
- Exact mass
- 134.0943 Da
- Density
- 0.984 g/mL (at 22 °C)
- Boiling point
- 167 °C
- logP
- 0.38Crippen estimate
- Polar surface area
- 38.7 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 5
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
621-63-6SMILES
CCOC(CO)OCCInChIKey
IKKUKDZKIIIKJK-UHFFFAOYSA-NInChI
InChI=1S/C6H14O3/c1-3-8-6(5-7)9-4-2/h6-7H,3-5H2,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
5 names
- Ethanol, 2,2-diethoxy-
- Glycolaldehyde, diethyl acetal
- Hydroxyacetaldehyde diethyl acetal
- 2-Hydroxyacetaldehyde diethyl acetal
- NSC 9255
Work with 2,2-Diethoxyethanol
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
3,3-Diethoxy-1-propanol16777-87-057 % similar
1,1,3,3-Tetraethoxypropane122-31-655 % similar
Bromoacetaldehyde diethyl acetal2032-35-148 % similar
2-Chloro-1,1-diethoxyethane621-62-548 % similar
Aminoacetaldehyde diethylacetal645-36-348 % similar
2,2-Dimethoxyethanol30934-97-545 % similar
Triethyl orthoformate122-51-045 % similar
3-Chloro-1,1-diethoxypropane35573-93-444 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.