chempirical

Ethyl 1,4-dioxaspiro(4.5)decane-8-carboxylate

C11H18O4CAS 1489-97-0214.26 g/mol

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AcetalEsterEther

Properties

Molecular formula
C11H18O4
Molar mass
214.26 g/mol
Exact mass
214.1205 Da
logP
1.48Crippen estimate
Polar surface area
44.8 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
2

Identifiers

CAS number
1489-97-0
SMILES
CCOC(=O)C1CCC2(CC1)OCCO2
InChIKey
UXXWGBLTOSRBAY-UHFFFAOYSA-N
InChI
InChI=1S/C11H18O4/c1-2-13-10(12)9-3-5-11(6-4-9)14-7-8-15-11/h9H,2-8H2,1H3

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Names and synonyms

1 names
  • Ethyl 1,4-dioxaspiro[4.5]decane-8-carboxylate

Work with Ethyl 1,4-dioxaspiro(4.5)decane-8-carboxylate

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

Ethyl cyclobutanecarboxylate14924-53-965 % similar Ethyl cyclopropanecarboxylate4606-07-963 % similar Ethyl 4,4-difluorocyclohexanecarboxylate178312-47-563 % similar Ethyl cyclohexanecarboxylate3289-28-963 % similar Ethyl isonipecotate1126-09-654 % similar Ethyl 4-oxocyclohexanecarboxylate17159-79-454 % similar trans-4-Aminocyclohexane carboxylic acid ethyl ester1678-68-853 % similar Ethyl 4-hydroxycyclohexanecarboxylate17159-80-753 % similar

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

Elsewhere

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