(6Z)-1,4-dioxaspiro[4.11]hexadec-6-ene

C14H24O2 — CID 10878823

IUPAC(6Z)-1,4-dioxaspiro[4.11]hexadec-6-ene
SMILESC1=C\C2(CCCCCCCCC/1)OCCO2
InChIInChI=1S/C14H24O2/c1-2-4-6-8-10-14(15-12-13-16-14)11-9-7-5-3-1/h8,10H,1-7,9,11-13H2/b10-8-
InChIKeyLVGMUVSYYLVFSQ-NTMALXAHSA-N
MW224.34 g/mol
LogP3.81
Rot. Bonds

About (6Z)-1,4-dioxaspiro[4.11]hexadec-6-ene

(6Z)-1,4-dioxaspiro[4.11]hexadec-6-ene (PubChem CID 10878823) has the molecular formula C14H24O2 and a molecular weight of 224.34 g/mol. Its IUPAC name is (6Z)-1,4-dioxaspiro[4.11]hexadec-6-ene.

Molecular Properties

Compound Name(6Z)-1,4-dioxaspiro[4.11]hexadec-6-ene
PubChem CID10878823
Molecular FormulaC14H24O2
Molecular Weight224.34 g/mol
Exact Mass224.18
IUPAC Name(6Z)-1,4-dioxaspiro[4.11]hexadec-6-ene
SMILESC1=C\C2(CCCCCCCCC/1)OCCO2
InChIInChI=1S/C14H24O2/c1-2-4-6-8-10-14(15-12-13-16-14)11-9-7-5-3-1/h8,10H,1-7,9,11-13H2/b10-8-
InChIKeyLVGMUVSYYLVFSQ-NTMALXAHSA-N
XLogP3.81
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.34
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (6Z)-1,4-dioxaspiro[4.11]hexadec-6-ene?
The IUPAC name of (6Z)-1,4-dioxaspiro[4.11]hexadec-6-ene (CID 10878823) is (6Z)-1,4-dioxaspiro[4.11]hexadec-6-ene.
What is the SMILES notation for (6Z)-1,4-dioxaspiro[4.11]hexadec-6-ene?
The canonical SMILES for (6Z)-1,4-dioxaspiro[4.11]hexadec-6-ene is C1=C\C2(CCCCCCCCC/1)OCCO2.
What is the InChIKey of (6Z)-1,4-dioxaspiro[4.11]hexadec-6-ene?
The InChIKey is LVGMUVSYYLVFSQ-NTMALXAHSA-N. The full InChI is InChI=1S/C14H24O2/c1-2-4-6-8-10-14(15-12-13-16-14)11-9-7-5-3-1/h8,10H,1-7,9,11-13H2/b10-8-.
What are the key properties of (6Z)-1,4-dioxaspiro[4.11]hexadec-6-ene?
(6Z)-1,4-dioxaspiro[4.11]hexadec-6-ene has a molecular weight of 224.34 g/mol, XLogP of 3.81, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-1,4-dioxaspiro[4.11]hexadec-6-ene is sourced from PubChem (CID 10878823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).