8-ethyl-1,4-dioxaspiro[4.5]decane

C10H18O2 — CID 21016596

IUPAC8-ethyl-1,4-dioxaspiro[4.5]decane
SMILESCCC1CCC2(CC1)OCCO2
InChIInChI=1S/C10H18O2/c1-2-9-3-5-10(6-4-9)11-7-8-12-10/h9H,2-8H2,1H3
InChIKeyFVPRSNSLHMPASJ-UHFFFAOYSA-N
MW170.25 g/mol
LogP2.33
Rot. Bonds1

About 8-ethyl-1,4-dioxaspiro[4.5]decane

8-ethyl-1,4-dioxaspiro[4.5]decane (PubChem CID 21016596) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol. Its IUPAC name is 8-ethyl-1,4-dioxaspiro[4.5]decane.

Molecular Properties

Compound Name8-ethyl-1,4-dioxaspiro[4.5]decane
PubChem CID21016596
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name8-ethyl-1,4-dioxaspiro[4.5]decane
SMILESCCC1CCC2(CC1)OCCO2
InChIInChI=1S/C10H18O2/c1-2-9-3-5-10(6-4-9)11-7-8-12-10/h9H,2-8H2,1H3
InChIKeyFVPRSNSLHMPASJ-UHFFFAOYSA-N
XLogP2.33
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-ethyl-1,4-dioxaspiro[4.5]decane?
The IUPAC name of 8-ethyl-1,4-dioxaspiro[4.5]decane (CID 21016596) is 8-ethyl-1,4-dioxaspiro[4.5]decane.
What is the SMILES notation for 8-ethyl-1,4-dioxaspiro[4.5]decane?
The canonical SMILES for 8-ethyl-1,4-dioxaspiro[4.5]decane is CCC1CCC2(CC1)OCCO2.
What is the InChIKey of 8-ethyl-1,4-dioxaspiro[4.5]decane?
The InChIKey is FVPRSNSLHMPASJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2/c1-2-9-3-5-10(6-4-9)11-7-8-12-10/h9H,2-8H2,1H3.
What are the key properties of 8-ethyl-1,4-dioxaspiro[4.5]decane?
8-ethyl-1,4-dioxaspiro[4.5]decane has a molecular weight of 170.25 g/mol, XLogP of 2.33, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-1,4-dioxaspiro[4.5]decane is sourced from PubChem (CID 21016596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).