(2R,5R)-2-ethenyl-1,10-dioxaspiro[4.5]decane

C10H16O2 — CID 134968390

IUPAC(2R,5R)-2-ethenyl-1,10-dioxaspiro[4.5]decane
SMILESC=C[C@H]1CC[C@@]2(CCCCO2)O1
InChIInChI=1S/C10H16O2/c1-2-9-5-7-10(12-9)6-3-4-8-11-10/h2,9H,1,3-8H2/t9-,10+/m0/s1
InChIKeyOXKDXECMGQCRPL-VHSXEESVSA-N
MW168.24 g/mol
LogP2.25
Rot. Bonds1

About (2R,5R)-2-ethenyl-1,10-dioxaspiro[4.5]decane

(2R,5R)-2-ethenyl-1,10-dioxaspiro[4.5]decane (PubChem CID 134968390) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is (2R,5R)-2-ethenyl-1,10-dioxaspiro[4.5]decane.

Molecular Properties

Compound Name(2R,5R)-2-ethenyl-1,10-dioxaspiro[4.5]decane
PubChem CID134968390
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name(2R,5R)-2-ethenyl-1,10-dioxaspiro[4.5]decane
SMILESC=C[C@H]1CC[C@@]2(CCCCO2)O1
InChIInChI=1S/C10H16O2/c1-2-9-5-7-10(12-9)6-3-4-8-11-10/h2,9H,1,3-8H2/t9-,10+/m0/s1
InChIKeyOXKDXECMGQCRPL-VHSXEESVSA-N
XLogP2.25
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2R,5R)-2-ethenyl-1,10-dioxaspiro[4.5]decane?
The IUPAC name of (2R,5R)-2-ethenyl-1,10-dioxaspiro[4.5]decane (CID 134968390) is (2R,5R)-2-ethenyl-1,10-dioxaspiro[4.5]decane.
What is the SMILES notation for (2R,5R)-2-ethenyl-1,10-dioxaspiro[4.5]decane?
The canonical SMILES for (2R,5R)-2-ethenyl-1,10-dioxaspiro[4.5]decane is C=C[C@H]1CC[C@@]2(CCCCO2)O1.
What is the InChIKey of (2R,5R)-2-ethenyl-1,10-dioxaspiro[4.5]decane?
The InChIKey is OXKDXECMGQCRPL-VHSXEESVSA-N. The full InChI is InChI=1S/C10H16O2/c1-2-9-5-7-10(12-9)6-3-4-8-11-10/h2,9H,1,3-8H2/t9-,10+/m0/s1.
What are the key properties of (2R,5R)-2-ethenyl-1,10-dioxaspiro[4.5]decane?
(2R,5R)-2-ethenyl-1,10-dioxaspiro[4.5]decane has a molecular weight of 168.24 g/mol, XLogP of 2.25, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5R)-2-ethenyl-1,10-dioxaspiro[4.5]decane is sourced from PubChem (CID 134968390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).