1,1-Dimethylethyl 3-[2-(2-aminoethoxy)ethoxy]propanoate

C11H23NO4CAS 756525-95-8233.31 g/mol

Open in Covalent MOL file
OOOONH2
EsterEtherPrimary amine

Properties

Molecular formula
C11H23NO4
Molar mass
233.31 g/mol
Exact mass
233.1627 Da
logP
0.71Crippen estimate
Polar surface area
70.8 Ų
H-bond donors / acceptors
1 / 5
Rotatable bonds
8

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
756525-95-8
SMILES
CC(C)(C)OC(=O)CCOCCOCCN
InChIKey
XIVHGTLMLORWEP-UHFFFAOYSA-N
InChI
InChI=1S/C11H23NO4/c1-11(2,3)16-10(13)4-6-14-8-9-15-7-5-12/h4-9,12H2,1-3H3

Weigh it out

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

Names and synonyms

5 names
  • Propanoic acid, 3-[2-(2-aminoethoxy)ethoxy]-, 1,1-dimethylethyl ester
  • tert-Butyl 3-[2-(2-aminoethoxy)ethoxy]propanoate
  • tert-Butyl 9-amino-4,7-dioxanonanoate
  • Amino-PEG2-t-butyl ester
  • 3-(2-(2-Aminoethoxy)ethoxy)propanoic acid t-butyl ester

Work with 1,1-Dimethylethyl 3-[2-(2-aminoethoxy)ethoxy]propanoate

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

tert-Butyl 12-amino-4 7 10-trioxa-dodeca252881-74-6100 % similar tert-Butyl 1-Amino-3,6,9,12-tetraoxapentadecan-15-oate581065-95-4100 % similar H2N-Peg8-tbu756526-06-4100 % similar Amino-peg1-T-butyl ester1260092-46-397 % similar tert-Butyl 3-(2-(2-hydroxyethoxy)ethoxy)propanoate133803-81-366 % similar tert-Butyl 12-hydroxy-4 7 10-trioxa-186020-66-666 % similar Ho-peg10-tbu778596-26-266 % similar tert-Butyl 3-(2-hydroxyethoxy)propanoate671802-00-963 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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