6-methyl-3-methylidene-1,4-dioxaspiro[4.5]decane

C10H16O2 — CID 13168930

IUPAC6-methyl-3-methylidene-1,4-dioxaspiro[4.5]decane
SMILESC=C1COC2(CCCCC2C)O1
InChIInChI=1S/C10H16O2/c1-8-5-3-4-6-10(8)11-7-9(2)12-10/h8H,2-7H2,1H3
InChIKeyLGHNKJVVGFMPCC-UHFFFAOYSA-N
MW168.24 g/mol
LogP2.45
Rot. Bonds

About 6-methyl-3-methylidene-1,4-dioxaspiro[4.5]decane

6-methyl-3-methylidene-1,4-dioxaspiro[4.5]decane (PubChem CID 13168930) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is 6-methyl-3-methylidene-1,4-dioxaspiro[4.5]decane.

Molecular Properties

Compound Name6-methyl-3-methylidene-1,4-dioxaspiro[4.5]decane
PubChem CID13168930
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name6-methyl-3-methylidene-1,4-dioxaspiro[4.5]decane
SMILESC=C1COC2(CCCCC2C)O1
InChIInChI=1S/C10H16O2/c1-8-5-3-4-6-10(8)11-7-9(2)12-10/h8H,2-7H2,1H3
InChIKeyLGHNKJVVGFMPCC-UHFFFAOYSA-N
XLogP2.45
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-methylidene-1,4-dioxaspiro[4.5]decane?
The IUPAC name of 6-methyl-3-methylidene-1,4-dioxaspiro[4.5]decane (CID 13168930) is 6-methyl-3-methylidene-1,4-dioxaspiro[4.5]decane.
What is the SMILES notation for 6-methyl-3-methylidene-1,4-dioxaspiro[4.5]decane?
The canonical SMILES for 6-methyl-3-methylidene-1,4-dioxaspiro[4.5]decane is C=C1COC2(CCCCC2C)O1.
What is the InChIKey of 6-methyl-3-methylidene-1,4-dioxaspiro[4.5]decane?
The InChIKey is LGHNKJVVGFMPCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O2/c1-8-5-3-4-6-10(8)11-7-9(2)12-10/h8H,2-7H2,1H3.
What are the key properties of 6-methyl-3-methylidene-1,4-dioxaspiro[4.5]decane?
6-methyl-3-methylidene-1,4-dioxaspiro[4.5]decane has a molecular weight of 168.24 g/mol, XLogP of 2.45, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-methylidene-1,4-dioxaspiro[4.5]decane is sourced from PubChem (CID 13168930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).