chempirical

Olean

C9H16O2CAS 180-84-7156.22 g/mol

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OO
AcetalEther

Properties

Molecular formula
C9H16O2
Molar mass
156.22 g/mol
Exact mass
156.1150 Da
Density
1.0167 g/mL (at 20 °C)
Boiling point
193 °C (at 750 Torr)
logP
2.08Crippen estimate
Polar surface area
18.5 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Identifiers

CAS number
180-84-7
SMILES
C1CCC2(CCCCO2)OC1
InChIKey
GBBVHDGKDQAEOT-UHFFFAOYSA-N
InChI
InChI=1S/C9H16O2/c1-3-7-10-9(5-1)6-2-4-8-11-9/h1-8H2

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Names and synonyms

1 names
  • 1,7-Dioxaspiro[5.5]undecane

Work with Olean

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

1,1-Diethoxycyclohexane1670-47-948 % similar 1,4-Dioxa-8-azaspiro[4.5]decane177-11-743 % similar 1,4-Dioxaspiro[4.5]decane-8,8-diyldimethanol1256546-72-138 % similar 1,4-Dioxaspiro[4.5]decan-8-one4746-97-838 % similar 1,1-Bis(1-methylethoxy)cyclohexane1132-95-233 % similar 1,1-Bis(tert-butylperoxy)cyclohexane3006-86-833 % similar 4-(1,4-Dioxaspiro[4.5]dec-8-yl)cyclohexanone56309-94-530 % similar

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

Same formula

Gamma-nonalactone104-61-0 2,2,6,6-Tetramethyl-2H-3,5,6-trihydropyran-4-one1197-66-6 Allyl hexanoate123-68-2 2,6-Dimethyl-3,5-heptanedione18362-64-6 Hexyl acrylate2499-95-8 4-Hydroxynonenal29343-52-0 Ethyl cyclohexanecarboxylate3289-28-9 Delta-nonalactone3301-94-8

Elsewhere

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