(8R,10R)-10-ethenyl-5,7,9-trioxadispiro[5.1.58.36]hexadecane

C15H24O3 — CID 134968346

IUPAC(8R,10R)-10-ethenyl-5,7,9-trioxadispiro[5.1.58.36]hexadecane
SMILESC=C[C@H]1CCC[C@@]2(CCCC3(CCCCO3)O2)O1
InChIInChI=1S/C15H24O3/c1-2-13-7-5-9-15(17-13)11-6-10-14(18-15)8-3-4-12-16-14/h2,13H,1,3-12H2/t13-,14?,15+/m0/s1
InChIKeyOIDJGGZVCVDAHF-ZHDDOTHNSA-N
MW252.35 g/mol
LogP3.54
Rot. Bonds1

About (8R,10R)-10-ethenyl-5,7,9-trioxadispiro[5.1.58.36]hexadecane

(8R,10R)-10-ethenyl-5,7,9-trioxadispiro[5.1.58.36]hexadecane (PubChem CID 134968346) has the molecular formula C15H24O3 and a molecular weight of 252.35 g/mol. Its IUPAC name is (8R,10R)-10-ethenyl-5,7,9-trioxadispiro[5.1.58.36]hexadecane.

Molecular Properties

Compound Name(8R,10R)-10-ethenyl-5,7,9-trioxadispiro[5.1.58.36]hexadecane
PubChem CID134968346
Molecular FormulaC15H24O3
Molecular Weight252.35 g/mol
Exact Mass252.17
IUPAC Name(8R,10R)-10-ethenyl-5,7,9-trioxadispiro[5.1.58.36]hexadecane
SMILESC=C[C@H]1CCC[C@@]2(CCCC3(CCCCO3)O2)O1
InChIInChI=1S/C15H24O3/c1-2-13-7-5-9-15(17-13)11-6-10-14(18-15)8-3-4-12-16-14/h2,13H,1,3-12H2/t13-,14?,15+/m0/s1
InChIKeyOIDJGGZVCVDAHF-ZHDDOTHNSA-N
XLogP3.54
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.35
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-Allyl-1,7-dioxaspiro[5.5]undecane
CID 14214422
2-[(4S,6S)-6-[[(4S,6S)-6-[[(4R,6R)-6-ethenyl-2,2-dimethyl-1,3-dioxan-4-yl]methyl]-2,2-dimethyl-1,3-dioxan-4-yl]methyl]-2,2-dimethyl-1,3-dioxan-4-yl]ethanol
CID 49856868
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-1,7-dioxaspiro[5.5]undecane
CID 134958873
(2R,6R)-2-ethenyl-1,12-dioxaspiro[5.6]dodecane
CID 134968331
(5S,7R)-7-ethenyl-1,6-dioxaspiro[4.5]decane
CID 134968336
(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 (8R,10R)-10-ethenyl-5,7,9-trioxadispiro[5.1.58.36]hexadecane?
The IUPAC name of (8R,10R)-10-ethenyl-5,7,9-trioxadispiro[5.1.58.36]hexadecane (CID 134968346) is (8R,10R)-10-ethenyl-5,7,9-trioxadispiro[5.1.58.36]hexadecane.
What is the SMILES notation for (8R,10R)-10-ethenyl-5,7,9-trioxadispiro[5.1.58.36]hexadecane?
The canonical SMILES for (8R,10R)-10-ethenyl-5,7,9-trioxadispiro[5.1.58.36]hexadecane is C=C[C@H]1CCC[C@@]2(CCCC3(CCCCO3)O2)O1.
What is the InChIKey of (8R,10R)-10-ethenyl-5,7,9-trioxadispiro[5.1.58.36]hexadecane?
The InChIKey is OIDJGGZVCVDAHF-ZHDDOTHNSA-N. The full InChI is InChI=1S/C15H24O3/c1-2-13-7-5-9-15(17-13)11-6-10-14(18-15)8-3-4-12-16-14/h2,13H,1,3-12H2/t13-,14?,15+/m0/s1.
What are the key properties of (8R,10R)-10-ethenyl-5,7,9-trioxadispiro[5.1.58.36]hexadecane?
(8R,10R)-10-ethenyl-5,7,9-trioxadispiro[5.1.58.36]hexadecane has a molecular weight of 252.35 g/mol, XLogP of 3.54, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8R,10R)-10-ethenyl-5,7,9-trioxadispiro[5.1.58.36]hexadecane is sourced from PubChem (CID 134968346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).