8-(4-fluorophenyl)-1,4-dioxaspiro[4.5]dec-7-ene

C14H15FO2 — CID 15232682

IUPAC8-(4-fluorophenyl)-1,4-dioxaspiro[4.5]dec-7-ene
SMILESFc1ccc(C2=CCC3(CC2)OCCO3)cc1
InChIInChI=1S/C14H15FO2/c15-13-3-1-11(2-4-13)12-5-7-14(8-6-12)16-9-10-17-14/h1-5H,6-10H2
InChIKeyDJECMZKAFHJFMI-UHFFFAOYSA-N
MW234.27 g/mol
LogP3.14
Rot. Bonds1

About 8-(4-fluorophenyl)-1,4-dioxaspiro[4.5]dec-7-ene

8-(4-fluorophenyl)-1,4-dioxaspiro[4.5]dec-7-ene (PubChem CID 15232682) has the molecular formula C14H15FO2 and a molecular weight of 234.27 g/mol. Its IUPAC name is 8-(4-fluorophenyl)-1,4-dioxaspiro[4.5]dec-7-ene.

Molecular Properties

Compound Name8-(4-fluorophenyl)-1,4-dioxaspiro[4.5]dec-7-ene
PubChem CID15232682
Molecular FormulaC14H15FO2
Molecular Weight234.27 g/mol
Exact Mass234.11
IUPAC Name8-(4-fluorophenyl)-1,4-dioxaspiro[4.5]dec-7-ene
SMILESFc1ccc(C2=CCC3(CC2)OCCO3)cc1
InChIInChI=1S/C14H15FO2/c15-13-3-1-11(2-4-13)12-5-7-14(8-6-12)16-9-10-17-14/h1-5H,6-10H2
InChIKeyDJECMZKAFHJFMI-UHFFFAOYSA-N
XLogP3.14
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.27
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-(4-fluorophenyl)-1,4-dioxaspiro[4.5]dec-7-ene?
The IUPAC name of 8-(4-fluorophenyl)-1,4-dioxaspiro[4.5]dec-7-ene (CID 15232682) is 8-(4-fluorophenyl)-1,4-dioxaspiro[4.5]dec-7-ene.
What is the SMILES notation for 8-(4-fluorophenyl)-1,4-dioxaspiro[4.5]dec-7-ene?
The canonical SMILES for 8-(4-fluorophenyl)-1,4-dioxaspiro[4.5]dec-7-ene is Fc1ccc(C2=CCC3(CC2)OCCO3)cc1.
What is the InChIKey of 8-(4-fluorophenyl)-1,4-dioxaspiro[4.5]dec-7-ene?
The InChIKey is DJECMZKAFHJFMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FO2/c15-13-3-1-11(2-4-13)12-5-7-14(8-6-12)16-9-10-17-14/h1-5H,6-10H2.
What are the key properties of 8-(4-fluorophenyl)-1,4-dioxaspiro[4.5]dec-7-ene?
8-(4-fluorophenyl)-1,4-dioxaspiro[4.5]dec-7-ene has a molecular weight of 234.27 g/mol, XLogP of 3.14, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(4-fluorophenyl)-1,4-dioxaspiro[4.5]dec-7-ene is sourced from PubChem (CID 15232682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).