7-[(Z)-prop-1-enyl]-1,4-dioxaspiro[4.5]dec-6-ene

C11H16O2 — CID 102254788

IUPAC7-[(Z)-prop-1-enyl]-1,4-dioxaspiro[4.5]dec-6-ene
SMILESC/C=C\C1=CC2(CCC1)OCCO2
InChIInChI=1S/C11H16O2/c1-2-4-10-5-3-6-11(9-10)12-7-8-13-11/h2,4,9H,3,5-8H2,1H3/b4-2-
InChIKeySLWCYMGJIVFRDE-RQOWECAXSA-N
MW180.25 g/mol
LogP2.42
Rot. Bonds1

About 7-[(Z)-prop-1-enyl]-1,4-dioxaspiro[4.5]dec-6-ene

7-[(Z)-prop-1-enyl]-1,4-dioxaspiro[4.5]dec-6-ene (PubChem CID 102254788) has the molecular formula C11H16O2 and a molecular weight of 180.25 g/mol. Its IUPAC name is 7-[(Z)-prop-1-enyl]-1,4-dioxaspiro[4.5]dec-6-ene.

Molecular Properties

Compound Name7-[(Z)-prop-1-enyl]-1,4-dioxaspiro[4.5]dec-6-ene
PubChem CID102254788
Molecular FormulaC11H16O2
Molecular Weight180.25 g/mol
Exact Mass180.12
IUPAC Name7-[(Z)-prop-1-enyl]-1,4-dioxaspiro[4.5]dec-6-ene
SMILESC/C=C\C1=CC2(CCC1)OCCO2
InChIInChI=1S/C11H16O2/c1-2-4-10-5-3-6-11(9-10)12-7-8-13-11/h2,4,9H,3,5-8H2,1H3/b4-2-
InChIKeySLWCYMGJIVFRDE-RQOWECAXSA-N
XLogP2.42
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-[(Z)-prop-1-enyl]-1,4-dioxaspiro[4.5]dec-6-ene?
The IUPAC name of 7-[(Z)-prop-1-enyl]-1,4-dioxaspiro[4.5]dec-6-ene (CID 102254788) is 7-[(Z)-prop-1-enyl]-1,4-dioxaspiro[4.5]dec-6-ene.
What is the SMILES notation for 7-[(Z)-prop-1-enyl]-1,4-dioxaspiro[4.5]dec-6-ene?
The canonical SMILES for 7-[(Z)-prop-1-enyl]-1,4-dioxaspiro[4.5]dec-6-ene is C/C=C\C1=CC2(CCC1)OCCO2.
What is the InChIKey of 7-[(Z)-prop-1-enyl]-1,4-dioxaspiro[4.5]dec-6-ene?
The InChIKey is SLWCYMGJIVFRDE-RQOWECAXSA-N. The full InChI is InChI=1S/C11H16O2/c1-2-4-10-5-3-6-11(9-10)12-7-8-13-11/h2,4,9H,3,5-8H2,1H3/b4-2-.
What are the key properties of 7-[(Z)-prop-1-enyl]-1,4-dioxaspiro[4.5]dec-6-ene?
7-[(Z)-prop-1-enyl]-1,4-dioxaspiro[4.5]dec-6-ene has a molecular weight of 180.25 g/mol, XLogP of 2.42, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(Z)-prop-1-enyl]-1,4-dioxaspiro[4.5]dec-6-ene is sourced from PubChem (CID 102254788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).