3-Oxo-1-oxa-8-aza-spiro[4.5]decane-8-carboxylic acid tert-butyl ester

C₁₃H₂₁NO₄CAS 954236-44-3255.31 g/mol

Open in Covalent MOL file

Carbamate Ether Ketone

Properties

Molecular formula: C₁₃H₂₁NO₄
Molar mass: 255.31 g/mol
Exact mass: 255.1471 Da
logP: 1.75Crippen estimate
Polar surface area: 55.8 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 0

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

954236-44-3

SMILES

CC(C)(C)OC(=O)N1CCC2(CC1)CC(=O)CO2

InChIKey

XDSCHYPLQWGQRC-UHFFFAOYSA-N

InChI

InChI=1S/C13H21NO4/c1-12(2,3)18-11(16)14-6-4-13(5-7-14)8-10(15)9-17-13/h4-9H2,1-3H3

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Names and synonyms

1 names

tert-Butyl 3-oxo-1-oxa-8-azaspiro[4.5]decane-8-carboxylate

Work with 3-Oxo-1-oxa-8-aza-spiro[4.5]decane-8-carboxylic acid tert-butyl ester

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 1-oxa-6-azaspiro(2.5)octane-6-carboxylate147804-30-666 % similar tert-Butyl 2-oxo-7-azaspiro[3.5]nonane-7-carboxylate203661-69-264 % similar 1,1-Dimethylethyl 9-oxo-3-azaspiro[5.5]undecane-3-carboxylate873924-08-459 % similar tert-Butyl 4-oxopiperidine-1-carboxylate79099-07-358 % similar tert-Butyl 2-oxo-6-azaspiro[3.4]octane-6-carboxylate203661-71-657 % similar tert-Butyl 4,4-difluoropiperidine-1-carboxylate281652-10-655 % similar 1,1-Dimethylethyl 1-pyrrolidinecarboxylate86953-79-954 % similar 7-Boc-2-oxa-7-azaspiro[3.5]nonane240401-27-854 % similar

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

Same formula

Ethyl (1R,2S)-1-[[(1,1-dimethylethoxy)carbonyl]amino]-2-ethenylcyclopropanecarboxylate259217-95-3

Elsewhere

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