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

C10H15FO2 — CID 88978830

IUPAC8-(1-fluoroethylidene)-1,4-dioxaspiro[4.5]decane
SMILESCC(F)=C1CCC2(CC1)OCCO2
InChIInChI=1S/C10H15FO2/c1-8(11)9-2-4-10(5-3-9)12-6-7-13-10/h2-7H2,1H3
InChIKeyPNFAWOYDNGVQSC-UHFFFAOYSA-N
MW186.23 g/mol
LogP2.55
Rot. Bonds

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

8-(1-fluoroethylidene)-1,4-dioxaspiro[4.5]decane (PubChem CID 88978830) has the molecular formula C10H15FO2 and a molecular weight of 186.23 g/mol. Its IUPAC name is 8-(1-fluoroethylidene)-1,4-dioxaspiro[4.5]decane.

Molecular Properties

Compound Name8-(1-fluoroethylidene)-1,4-dioxaspiro[4.5]decane
PubChem CID88978830
Molecular FormulaC10H15FO2
Molecular Weight186.23 g/mol
Exact Mass186.11
IUPAC Name8-(1-fluoroethylidene)-1,4-dioxaspiro[4.5]decane
SMILESCC(F)=C1CCC2(CC1)OCCO2
InChIInChI=1S/C10H15FO2/c1-8(11)9-2-4-10(5-3-9)12-6-7-13-10/h2-7H2,1H3
InChIKeyPNFAWOYDNGVQSC-UHFFFAOYSA-N
XLogP2.55
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.23
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-(1-fluoroethylidene)-1,4-dioxaspiro[4.5]decane?
The IUPAC name of 8-(1-fluoroethylidene)-1,4-dioxaspiro[4.5]decane (CID 88978830) is 8-(1-fluoroethylidene)-1,4-dioxaspiro[4.5]decane.
What is the SMILES notation for 8-(1-fluoroethylidene)-1,4-dioxaspiro[4.5]decane?
The canonical SMILES for 8-(1-fluoroethylidene)-1,4-dioxaspiro[4.5]decane is CC(F)=C1CCC2(CC1)OCCO2.
What is the InChIKey of 8-(1-fluoroethylidene)-1,4-dioxaspiro[4.5]decane?
The InChIKey is PNFAWOYDNGVQSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FO2/c1-8(11)9-2-4-10(5-3-9)12-6-7-13-10/h2-7H2,1H3.
What are the key properties of 8-(1-fluoroethylidene)-1,4-dioxaspiro[4.5]decane?
8-(1-fluoroethylidene)-1,4-dioxaspiro[4.5]decane has a molecular weight of 186.23 g/mol, XLogP of 2.55, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(1-fluoroethylidene)-1,4-dioxaspiro[4.5]decane is sourced from PubChem (CID 88978830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).