8-(2,2-diphenylethenylidene)-1,4-dioxaspiro[4.5]decane

C22H22O2 — CID 11278583

IUPAC8-(2,2-diphenylethenylidene)-1,4-dioxaspiro[4.5]decane
SMILESC(=C1CCC2(CC1)OCCO2)=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H22O2/c1-3-7-19(8-4-1)21(20-9-5-2-6-10-20)17-18-11-13-22(14-12-18)23-15-16-24-22/h1-10H,11-16H2
InChIKeyAAKUBKFZOJESHR-UHFFFAOYSA-N
MW318.42 g/mol
LogP4.96
Rot. Bonds2

About 8-(2,2-diphenylethenylidene)-1,4-dioxaspiro[4.5]decane

8-(2,2-diphenylethenylidene)-1,4-dioxaspiro[4.5]decane (PubChem CID 11278583) has the molecular formula C22H22O2 and a molecular weight of 318.42 g/mol. Its IUPAC name is 8-(2,2-diphenylethenylidene)-1,4-dioxaspiro[4.5]decane.

Molecular Properties

Compound Name8-(2,2-diphenylethenylidene)-1,4-dioxaspiro[4.5]decane
PubChem CID11278583
Molecular FormulaC22H22O2
Molecular Weight318.42 g/mol
Exact Mass318.16
IUPAC Name8-(2,2-diphenylethenylidene)-1,4-dioxaspiro[4.5]decane
SMILESC(=C1CCC2(CC1)OCCO2)=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H22O2/c1-3-7-19(8-4-1)21(20-9-5-2-6-10-20)17-18-11-13-22(14-12-18)23-15-16-24-22/h1-10H,11-16H2
InChIKeyAAKUBKFZOJESHR-UHFFFAOYSA-N
XLogP4.96
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-(2,2-diphenylethenylidene)-1,4-dioxaspiro[4.5]decane?
The IUPAC name of 8-(2,2-diphenylethenylidene)-1,4-dioxaspiro[4.5]decane (CID 11278583) is 8-(2,2-diphenylethenylidene)-1,4-dioxaspiro[4.5]decane.
What is the SMILES notation for 8-(2,2-diphenylethenylidene)-1,4-dioxaspiro[4.5]decane?
The canonical SMILES for 8-(2,2-diphenylethenylidene)-1,4-dioxaspiro[4.5]decane is C(=C1CCC2(CC1)OCCO2)=C(c1ccccc1)c1ccccc1.
What is the InChIKey of 8-(2,2-diphenylethenylidene)-1,4-dioxaspiro[4.5]decane?
The InChIKey is AAKUBKFZOJESHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22O2/c1-3-7-19(8-4-1)21(20-9-5-2-6-10-20)17-18-11-13-22(14-12-18)23-15-16-24-22/h1-10H,11-16H2.
What are the key properties of 8-(2,2-diphenylethenylidene)-1,4-dioxaspiro[4.5]decane?
8-(2,2-diphenylethenylidene)-1,4-dioxaspiro[4.5]decane has a molecular weight of 318.42 g/mol, XLogP of 4.96, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2,2-diphenylethenylidene)-1,4-dioxaspiro[4.5]decane is sourced from PubChem (CID 11278583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).