Diethylene glycol monomethyl ether acetate

C₇H₁₄O₄CAS 629-38-9162.19 g/mol

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Properties

Molecular formula: C₇H₁₄O₄
Molar mass: 162.19 g/mol
Exact mass: 162.0892 Da
Boiling point: 85–95 °C (at 0.2 Torr)
logP: 0.21Crippen estimate
Polar surface area: 44.8 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 6

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

629-38-9

SMILES

COCCOCCOC(C)=O

InChIKey

BJINVQNEBGOMCR-UHFFFAOYSA-N

InChI

InChI=1S/C7H14O4/c1-7(8)11-6-5-10-4-3-9-2/h3-6H2,1-2H3

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Names and synonyms

5 names

Ethanol, 2-(2-methoxyethoxy)-, 1-acetate
Ethanol, 2-(2-methoxyethoxy)-, acetate
Methyl carbitol acetate
Diethylene glycol methyl ether acetate
2-(2-Methoxyethoxy)ethyl acetate

Work with Diethylene glycol monomethyl ether 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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Ethylene glycol monomethyl ether acetate110-49-687 % similar 1,8-Diacetoxy-3,6-dioxaoctane111-21-778 % similar Oxydiethylene acetate628-68-278 % similar Glycol diacetate111-55-765 % similar Carbitol acetate112-15-264 % similar 2-((Acetyloxy)methoxy)ethyl acetate59278-00-163 % similar 2-Ethoxyethyl acetate111-15-961 % similar 2-Butoxyethanol acetate112-07-260 % similar

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

Same formula

(4S,5S)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanol50622-09-8 (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanol73346-74-4

Elsewhere

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