1,6-Dioxaspiro(4.4)nonane, 2-(2-(tetrahydro-2-furyl)ethyl)-

HCID 45284

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Basic information

CAS: 63917-47-5
Standard SMILES: C1COC(CCC2CCC3(CCCO3)O2)C1
InChIKey: LOVYECFMRPYLLZ-UHFFFAOYSA-N
Molecular formula: C13H22O3
Average molar mass: 226.31 g/mol
Monoisotopic mass: 226.15689456

Names & identifiers

Preferred name: 1,6-Dioxaspiro(4.4)nonane, 2-(2-(tetrahydro-2-furyl)ethyl)-
IUPAC: 2-[2-(oxolan-2-yl)ethyl]-1,6-dioxaspiro[4.4]nonane
English name: 2-[2-(Tetrahydrofuran-2-yl)ethyl]-1,6-dioxaspiro[4.4]nonane
Molecular formula: C13H22O3
Molecular weight: 226.31

Names & synonyms

BRN 012306963917-47-52-(2-(Tetrahydro-2-furyl)ethyl)-1,6-dioxaspiro(4.4)nonane1,6-DIOXASPIRO(4.4)NONANE, 2-(2-(TETRAHYDRO-2-FURYL)ETHYL)-4-19-00-04744 (Beilstein Handbook Reference)RefChem:2215612-[2-(oxolan-2-yl)ethyl]-1,6-dioxaspiro[4.4]nonaneDTXSID00981062DB-2924882-[2-(Tetrahydrofuran-2-yl)ethyl ]-1,6-dioxaspiro[4.4]nonane2-[2-(Tetrahydrofuran-2-yl)ethyl]-1,6-dioxaspiro[4.4]nonane1,6-Dioxaspiro[4.4]nonane, 2-[2-(tetrahydro-2-furanyl)ethyl]-

Database identifiers

CAS: 63917-47-5
PubChem CID: 45284
DTXSID: DTXSID00981062
Nikkaji: J83.696F

Properties

Computed structural properties

XLogP: 2.1
Topological polar surface area: 27.7 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 16
Formal charge: 0
Complexity: 243

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