chempirical

Glycol monoacetate

C4H8O3CAS 542-59-6104.11 g/mol

Open in Covalent MOL file
OOOH
AlcoholEster

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
logP
-0.46Crippen estimate
Polar surface area
46.5 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
2

Identifiers

CAS number
542-59-6
SMILES
CC(=O)OCCO
InChIKey
HXDLWJWIAHWIKI-UHFFFAOYSA-N
InChI
InChI=1S/C4H8O3/c1-4(6)7-3-2-5/h5H,2-3H2,1H3

Weigh 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

Same formula

(+)-Methyl lactate17392-83-5 (-)-Methyl lactate27871-49-4 Beta-hydroxybutyric acid300-85-6 (S)-2-Hydroxybutyric acid3347-90-8 Erythritan4358-64-9 1,3-Dioxan-5-ol4740-78-7 2,2-Dimethoxyacetaldehyde51673-84-8 1,3-Dioxolane-4-methanol5464-28-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook