9-methyl-6-oxaspiro[4.5]dec-8-ene

C10H16O — CID 642972

IUPAC9-methyl-6-oxaspiro[4.5]dec-8-ene
SMILESCC1=CCOC2(CCCC2)C1
InChIInChI=1S/C10H16O/c1-9-4-7-11-10(8-9)5-2-3-6-10/h4H,2-3,5-8H2,1H3
InChIKeyWKSCEPQWFRTIDJ-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.67
Rot. Bonds

About 9-methyl-6-oxaspiro[4.5]dec-8-ene

9-methyl-6-oxaspiro[4.5]dec-8-ene (PubChem CID 642972) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 9-methyl-6-oxaspiro[4.5]dec-8-ene.

Molecular Properties

Compound Name9-methyl-6-oxaspiro[4.5]dec-8-ene
PubChem CID642972
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name9-methyl-6-oxaspiro[4.5]dec-8-ene
SMILESCC1=CCOC2(CCCC2)C1
InChIInChI=1S/C10H16O/c1-9-4-7-11-10(8-9)5-2-3-6-10/h4H,2-3,5-8H2,1H3
InChIKeyWKSCEPQWFRTIDJ-UHFFFAOYSA-N
XLogP2.67
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 9-methyl-6-oxaspiro[4.5]dec-8-ene?
The IUPAC name of 9-methyl-6-oxaspiro[4.5]dec-8-ene (CID 642972) is 9-methyl-6-oxaspiro[4.5]dec-8-ene.
What is the SMILES notation for 9-methyl-6-oxaspiro[4.5]dec-8-ene?
The canonical SMILES for 9-methyl-6-oxaspiro[4.5]dec-8-ene is CC1=CCOC2(CCCC2)C1.
What is the InChIKey of 9-methyl-6-oxaspiro[4.5]dec-8-ene?
The InChIKey is WKSCEPQWFRTIDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-9-4-7-11-10(8-9)5-2-3-6-10/h4H,2-3,5-8H2,1H3.
What are the key properties of 9-methyl-6-oxaspiro[4.5]dec-8-ene?
9-methyl-6-oxaspiro[4.5]dec-8-ene has a molecular weight of 152.24 g/mol, XLogP of 2.67, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-6-oxaspiro[4.5]dec-8-ene is sourced from PubChem (CID 642972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).