chempirical

Neopentyl glycol diglycidyl ether

C11H20O4CAS 17557-23-2216.28 g/mol

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EpoxideEther

Properties

Molecular formula
C11H20O4
Molar mass
216.28 g/mol
Exact mass
216.1362 Da
Density
1.07 g/mL
Flash point
88 °C (open cup)
Water solubility
5–10 g/L (20.5 °C)
logP
0.84Crippen estimate
Polar surface area
43.5 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
8

Hazards

Warning
Irritant (GHS07)

Harmonised EU classification (CLP Annex VI, index 603-094-00-7), via PubChem.

Precautionary statements

P261, P264, P272, P280, P302+P352, P321, P332+P317, P333+P317, P362+P364, P501

Identifiers

CAS number
17557-23-2
SMILES
CC(C)(COCC1CO1)COCC1CO1
InChIKey
KUAUJXBLDYVELT-UHFFFAOYSA-N
InChI
InChI=1S/C11H20O4/c1-11(2,7-12-3-9-5-14-9)8-13-4-10-6-15-10/h9-10H,3-8H2,1-2H3

Weigh it out

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

Names and synonyms

10 names
  • Oxirane, 2,2′-[(2,2-dimethyl-1,3-propanediyl)bis(oxymethylene)]bis-
  • Propane, 1,3-bis(2,3-epoxypropoxy)-2,2-dimethyl-
  • 2,2′-[(2,2-Dimethyl-1,3-propanediyl)bis(oxymethylene)]bis[oxirane]
  • 1,3-Bis(glycidyloxy)-2,2-dimethylpropane
  • 1,3-Bis(2,3-epoxypropoxy)-2,2-dimethylpropane
  • 2,2-Bis(glycidyloxymethyl)propane
  • Diglycidyl neopentyl glycol
  • 2,2′-(((2,2-Dimethylpropane-1,3-diyl)bis(oxy))bis(methylene))bis(oxirane)
  • Neopentyl diglycidyl ether
  • 2-[[2,2-Dimethyl-3-(oxiran-2-ylmethoxy)propoxy]methyl]oxirane

Work with Neopentyl glycol diglycidyl 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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,3-Bis(2,3-epoxypropoxy)-2,2-bis((2,3-epoxypropoxy)methyl)propane3126-63-461 % similar Triglycidylglycerol13236-02-752 % similar Diglycidyl ether2238-07-552 % similar Glycol diglycidyl ether2224-15-948 % similar 2-[(2,2,3,3-Tetrafluoropropoxy)methyl]oxirane19932-26-447 % similar 2-((1,1-Dimethylethoxy)methyl)oxirane7665-72-746 % similar 1,4-Butanediol diglycidyl ether2425-79-844 % similar n-Butyl glycidyl ether2426-08-643 % similar

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

Same formula

Diethyl isobutylmalonate10203-58-4 1,3-Diethyl 2-butylpropanedioate133-08-4 Dimethyl azelate1732-10-1 Undecanedioic acid1852-04-6 Diethyl pimelate2050-20-6 2,2,6,6-Tetramethylpimelic acid2941-45-9 1,3-Bis(1,1-dimethylethyl) propanedioate541-16-2 Butyl butyryllactate7492-70-8

Elsewhere

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