Dimethylaminoethyl acetate

C6H13NO2CAS 1421-89-2131.18 g/mol

Open in Covalent MOL file
OON
EsterTertiary amine

Properties

Molecular formula
C6H13NO2
Molar mass
131.18 g/mol
Exact mass
131.0946 Da
Density
0.932 g/mL (at 25 °C)
Melting point
129–130 °C
Boiling point
86–88 °C (at 10 Torr)
pKa
8.4
logP
0.11Crippen estimate
Polar surface area
29.5 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
3

Hazards

Warning
Flammable (GHS02)Irritant (GHS07)

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P264, P264+P265, P280, P302+P352, P303+P361+P353, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P235, P501

Identifiers

CAS number
1421-89-2
SMILES
CC(=O)OCCN(C)C
InChIKey
GOLSFPMYASLXJC-UHFFFAOYSA-N
InChI
InChI=1S/C6H13NO2/c1-6(8)9-5-4-7(2)3/h4-5H2,1-3H3

Weigh it out

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

Names and synonyms

9 names
  • Acetic acid, 2-(dimethylamino)ethyl ester
  • Ethanol, 2-(dimethylamino)-, acetate
  • 2-(Dimethylamino)ethyl acetate
  • Dimethylaminoethanol acetate
  • 2-Dimethylaminoethanol acetate
  • 2-(N,N-Dimethylamino)-1-acetyloxyethane
  • 2-(N,N-Dimethylamino)ethyl acetate
  • NSC 7511
  • N,N-Dimethylaminoethyl acetate

Work with Dimethylaminoethyl 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

Glycol diacetate111-55-761 % similar 1,3-Diacetoxypropane628-66-056 % similar Butylene glycol diacetate628-67-156 % similar Ethylene glycol monomethyl ether acetate110-49-656 % similar 1,8-Diacetoxy-3,6-dioxaoctane111-21-754 % similar Hexylene glycol diacetate6222-17-954 % similar Oxydiethylene acetate628-68-254 % similar 1,5-Diacetoxypentane6963-44-654 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

L-Alloisoleucine1509-34-8 D-Alloisoleucine1509-35-9 tert-Butyl methylcarbamate16066-84-5 L-tert-Leucine20859-02-3 N-Methyl-L-valine2480-23-1 D-tert-Leucine26782-71-8 D-Isoleucine319-78-8 D-Norleucine327-56-0

Elsewhere

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