chempirical

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

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

4 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

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

Amino-peg1-T-butyl ester1260092-46-397 % similar tert-Butyl [2-(2-aminoethoxy)ethyl]carbamate127828-22-254 % similar 1,1-Dimethylethyl 13-amino-5,8,11-trioxa-2-azatridecanoate101187-40-049 % similar Glycine tert-butyl ester hydrochloride27532-96-347 % similar 27-Amino-4,7,10,13,16,19,22,25-octaoxaheptacosanoic acid756526-04-247 % similar 1,1-Dimethylethyl 4-bromobutanoate110661-91-146 % similar tert-Butyl propionate20487-40-544 % similar tert-Butyl chloroacetate107-59-543 % similar

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

Elsewhere

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