chempirical

Oxydiethylene acetate

C8H14O5CAS 628-68-2190.19 g/mol

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EsterEther

Properties

Molecular formula
C8H14O5
Molar mass
190.19 g/mol
Exact mass
190.0841 Da
Density
1.1078 g/mL (at 15 °C)
Melting point
18 °C
Boiling point
200 °C
logP
0.13Crippen estimate
Polar surface area
61.8 Ų
H-bond donors / acceptors
0 / 5
Rotatable bonds
6

Identifiers

CAS number
628-68-2
SMILES
CC(=O)OCCOCCOC(C)=O
InChIKey
UBPGILLNMDGSDS-UHFFFAOYSA-N
InChI
InChI=1S/C8H14O5/c1-7(9)12-5-3-11-4-6-13-8(2)10/h3-6H2,1-2H3

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Names and synonyms

6 names
  • Diethylene glycol, diacetate
  • Ethanol, 2,2′-oxybis-, 1,1′-diacetate
  • Ethanol, 2,2′-oxybis-, diacetate
  • NSC 6310
  • Bis(2-acetoxyethyl) ether
  • 2-(2-Acetyloxyethoxy)ethyl acetate

Work with Oxydiethylene acetate

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

1,8-Diacetoxy-3,6-dioxaoctane111-21-7100 % similar Glycol diacetate111-55-783 % similar Carbitol acetate112-15-278 % similar Diethylene glycol monomethyl ether acetate629-38-978 % similar (2-Acetoxyethoxy)methyl acetate59278-00-177 % similar 2-Ethoxyethyl acetate111-15-974 % similar 2-Butoxyethanol acetate112-07-272 % similar Diethylene glycol monobutyl ether acetate124-17-472 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

1,2-O-Isopropylidene-A-L-xylofuranose114861-22-2 1,2-O-Isopropylidene-α-D-xylofuranose20031-21-4

Elsewhere

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