chempirical

7-Boc-2-oxa-7-azaspiro[3.5]nonane

C12H21NO3CAS 240401-27-8227.30 g/mol

Open in Covalent MOL file
OONO
CarbamateEther

Properties

Molecular formula
C12H21NO3
Molar mass
227.30 g/mol
Exact mass
227.1521 Da
logP
2.03Crippen estimate
Polar surface area
38.8 Ų
H-bond donors / acceptors
0 / 3
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
240401-27-8
SMILES
CC(C)(C)OC(=O)N1CCC2(CC1)COC2
InChIKey
YVHPBSHIEPPQDC-UHFFFAOYSA-N
InChI
InChI=1S/C12H21NO3/c1-11(2,3)16-10(14)13-6-4-12(5-7-13)8-15-9-12/h4-9H2,1-3H3

Weigh it out

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

Names and synonyms

4 names
  • 1,1-Dimethylethyl 2-oxa-7-azaspiro[3.5]nonane-7-carboxylate
  • 2-Oxa-7-azaspiro[3.5]nonane-7-carboxylic acid, 1,1-dimethylethyl ester
  • 2-Oxa-7-azaspiro[3.5]nonane-7-carboxylic acid tert-butyl ester
  • tert-Butyl 2-oxa-7-azaspiro[3.5]nonan-7-carboxylate

Work with 7-Boc-2-oxa-7-azaspiro[3.5]nonane

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 2-oxo-7-azaspiro[3.5]nonane-7-carboxylate203661-69-269 % similar tert-Butyl 2,7-diazaspiro[3.5]nonane-7-carboxylate896464-16-769 % similar tert-Butyl 3,9-diazaspiro[5.5]undecane-3-carboxylate173405-78-267 % similar 1,1-Dimethylethyl 9-oxo-3-azaspiro[5.5]undecane-3-carboxylate873924-08-467 % similar tert-Butyl 1-oxa-6-azaspiro(2.5)octane-6-carboxylate147804-30-666 % similar tert-Butyl 2,7-diazaspiro(3.5)nonane-7-carboxylate hydrochloride1023301-84-963 % similar 2,8-Diaza-spiro[4.5]decane-8-carboxylic acid tert-butyl ester236406-39-663 % similar tert-Butyl 4,4-difluoropiperidine-1-carboxylate281652-10-663 % similar

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

Same formula

tert-Butyl 2-oxa-6-azaspiro[3.5]nonane-6-carboxylate1245816-29-8 tert-Butyl 3-endo-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxylate143557-91-9 rac-tert-Butyl N-[(1r,4r)-4-formylcyclohexyl]carbamate181308-57-6 1-Boc-4-formyl-4-methyl-piperidine189442-92-0 4-Acetyl-piperidine-1-carboxylic acid tert-butyl ester206989-61-9 1-(tert-Butoxycarbonyl)-3,3-dimethyl-4-oxopiperidine324769-06-4 tert-Butyl 2,2-dimethyl-4-oxopiperidine-1-carboxylate346593-03-1 1,1-Dimethylethyl N-methyl-N-(4-oxocyclohexyl)carbamate400899-84-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook