Glycol monoacetate
Properties
- Molecular formula
- C4H8O3
- Molar mass
- 104.11 g/mol
- Exact mass
- 104.0473 Da
- Density
- 1.1186 g/mL (at 10.01 °C)
- Boiling point
- 188 °C
- Flash point
- 101.7 °C
- Water solubility
- ≥ 100 g/L (21.1 °C)
- logP
- -0.46Crippen estimate
- Polar surface area
- 46.5 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 2
Hazards
Danger
- H318 Causes serious eye damage100% of notifiers
Aggregated from 42 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P264+P265, P280, P305+P354+P338, P317
Identifiers
CAS number
542-59-6SMILES
CC(=O)OCCOInChIKey
HXDLWJWIAHWIKI-UHFFFAOYSA-NInChI
InChI=1S/C4H8O3/c1-4(6)7-3-2-5/h5H,2-3H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
11 names
- 1,2-Ethanediol, 1-acetate
- Ethylene glycol, monoacetate
- 1,2-Ethanediol, monoacetate
- 2-Hydroxyethyl acetate
- 2-Acetoxyethanol
- β-Hydroxyethyl acetate
- Ethylenediol monoacetate
- Monoacetyl ethylene glycol
- NSC 9234
- Ethylene glycol monoacetate
- 1-O-Acetyl ethylene glycol
Work with Glycol monoacetate
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
Glycol diacetate111-55-767 % similar
1,3-Diacetoxypropane628-66-061 % similar
Butylene glycol diacetate628-67-161 % similar
1,8-Diacetoxy-3,6-dioxaoctane111-21-758 % similar
Hexylene glycol diacetate6222-17-958 % similar
Oxydiethylene acetate628-68-258 % similar
1,5-Diacetoxypentane6963-44-658 % similar
Propyl acetate109-60-456 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.