Propylene glycol dimethyl ether

C5H12O2CAS 7778-85-0104.15 g/mol

Open in Covalent MOL file
OO
Ether

Properties

Molecular formula
C5H12O2
Molar mass
104.15 g/mol
Exact mass
104.0837 Da
Boiling point
96 °C
logP
0.67Crippen estimate
Polar surface area
18.5 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
3

Hazards

Danger
Flammable (GHS02)

Harmonised EU classification (CLP Annex VI, index 603-100-00-8), via PubChem.

Precautionary statements

P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, P501

Identifiers

CAS number
7778-85-0
SMILES
COCC(C)OC
InChIKey
LEEANUDEDHYDTG-UHFFFAOYSA-N
InChI
InChI=1S/C5H12O2/c1-5(7-3)4-6-2/h5H,4H2,1-3H3

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Type any one amount. The others follow from the molar mass.

Names and synonyms

4 names
  • Propane, 1,2-dimethoxy-
  • 1,2-Dimethoxypropane
  • DMFDG
  • Hisolve MMPOM

Work with Propylene glycol dimethyl ether

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

1,1,2-Trimethoxyethane24332-20-552 % similar Dipropylene glycol monomethyl ether34590-94-848 % similar 1,1,3-Trimethoxybutane10138-89-348 % similar 2-Methoxy-1-propanol1589-47-548 % similar Propylene glycol methyl ether acetate108-65-646 % similar Tripropyleneglycol monomethyl ether20324-33-846 % similar Propylene glycol methyl ether107-98-242 % similar (2S)-1-Methoxypropan-2-ol26550-55-042 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Isopropylethanediol109-59-1 1,5-Pentanediol111-29-5 4-Methoxy-1-butanol111-32-0 3-Ethoxy-1-propanol111-35-3 Neopentyl glycol126-30-7 1-Ethoxy-2-propanol1569-02-4 (2R)-2-Methyl-1,4-butanediol22644-28-6 3-Methoxybutanol2517-43-3

Elsewhere

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