(2R,6R)-2-ethenyl-1,7-dioxaspiro[5.5]undecane

C11H18O2 — CID 134958873

IUPAC(2R,6R)-2-ethenyl-1,7-dioxaspiro[5.5]undecane
SMILESC=C[C@H]1CCC[C@@]2(CCCCO2)O1
InChIInChI=1S/C11H18O2/c1-2-10-6-5-8-11(13-10)7-3-4-9-12-11/h2,10H,1,3-9H2/t10-,11+/m0/s1
InChIKeyAEWJJYLKQCSKBG-WDEREUQCSA-N
MW182.26 g/mol
LogP2.64
Rot. Bonds1

About (2R,6R)-2-ethenyl-1,7-dioxaspiro[5.5]undecane

(2R,6R)-2-ethenyl-1,7-dioxaspiro[5.5]undecane (PubChem CID 134958873) has the molecular formula C11H18O2 and a molecular weight of 182.26 g/mol. Its IUPAC name is (2R,6R)-2-ethenyl-1,7-dioxaspiro[5.5]undecane.

Molecular Properties

Compound Name(2R,6R)-2-ethenyl-1,7-dioxaspiro[5.5]undecane
PubChem CID134958873
Molecular FormulaC11H18O2
Molecular Weight182.26 g/mol
Exact Mass182.13
IUPAC Name(2R,6R)-2-ethenyl-1,7-dioxaspiro[5.5]undecane
SMILESC=C[C@H]1CCC[C@@]2(CCCCO2)O1
InChIInChI=1S/C11H18O2/c1-2-10-6-5-8-11(13-10)7-3-4-9-12-11/h2,10H,1,3-9H2/t10-,11+/m0/s1
InChIKeyAEWJJYLKQCSKBG-WDEREUQCSA-N
XLogP2.64
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.26
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-Oct-1-en-3-yloxyoxane
CID 10727282
2-Allyl-1,7-dioxaspiro[5.5]undecane
CID 14214422
5-Methylidene-1,7-dioxaspiro[5.5]undecane
CID 86048919
2,8-Bis(ethenyl)-1,7-dioxaspiro[5.5]undecane
CID 134840281
2,8-bis[(E)-prop-1-enyl]-1,7-dioxaspiro[5.5]undecane
CID 134858588
(2R,6R)-2-ethenyl-1,12-dioxaspiro[5.6]dodecane
CID 134968331
(5S,7R)-7-ethenyl-1,6-dioxaspiro[4.5]decane
CID 134968336
(8R,10R)-10-ethenyl-5,7,9-trioxadispiro[5.1.58.36]hexadecane
CID 134968346
(2R,5R)-2-ethenyl-1,10-dioxaspiro[4.5]decane
CID 134968390
(2R,6S)-2-ethenyl-9,9-dimethyl-1,7-dioxaspiro[5.5]undecane
CID 134968451
2-Ethenyl-1,7-dioxaspiro[5.5]undecane
CID 154714568
8-methyl-2-[(E)-prop-1-enyl]-1,7-dioxaspiro[5.5]undecane
CID 162415276

Frequently Asked Questions

What is the IUPAC name of (2R,6R)-2-ethenyl-1,7-dioxaspiro[5.5]undecane?
The IUPAC name of (2R,6R)-2-ethenyl-1,7-dioxaspiro[5.5]undecane (CID 134958873) is (2R,6R)-2-ethenyl-1,7-dioxaspiro[5.5]undecane.
What is the SMILES notation for (2R,6R)-2-ethenyl-1,7-dioxaspiro[5.5]undecane?
The canonical SMILES for (2R,6R)-2-ethenyl-1,7-dioxaspiro[5.5]undecane is C=C[C@H]1CCC[C@@]2(CCCCO2)O1.
What is the InChIKey of (2R,6R)-2-ethenyl-1,7-dioxaspiro[5.5]undecane?
The InChIKey is AEWJJYLKQCSKBG-WDEREUQCSA-N. The full InChI is InChI=1S/C11H18O2/c1-2-10-6-5-8-11(13-10)7-3-4-9-12-11/h2,10H,1,3-9H2/t10-,11+/m0/s1.
What are the key properties of (2R,6R)-2-ethenyl-1,7-dioxaspiro[5.5]undecane?
(2R,6R)-2-ethenyl-1,7-dioxaspiro[5.5]undecane has a molecular weight of 182.26 g/mol, XLogP of 2.64, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6R)-2-ethenyl-1,7-dioxaspiro[5.5]undecane is sourced from PubChem (CID 134958873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).