6,6-dimethyl-4,8-dioxaspiro[2.5]oct-1-ene

C8H12O2 — CID 543319

IUPAC6,6-dimethyl-4,8-dioxaspiro[2.5]oct-1-ene
SMILESCC1(C)COC2(C=C2)OC1
InChIInChI=1S/C8H12O2/c1-7(2)5-9-8(3-4-8)10-6-7/h3-4H,5-6H2,1-2H3
InChIKeyAINMINDCBBSFAO-UHFFFAOYSA-N
MW140.18 g/mol
LogP1.33
Rot. Bonds

About 6,6-dimethyl-4,8-dioxaspiro[2.5]oct-1-ene

6,6-dimethyl-4,8-dioxaspiro[2.5]oct-1-ene (PubChem CID 543319) has the molecular formula C8H12O2 and a molecular weight of 140.18 g/mol. Its IUPAC name is 6,6-dimethyl-4,8-dioxaspiro[2.5]oct-1-ene.

Molecular Properties

Compound Name6,6-dimethyl-4,8-dioxaspiro[2.5]oct-1-ene
PubChem CID543319
Molecular FormulaC8H12O2
Molecular Weight140.18 g/mol
Exact Mass140.08
IUPAC Name6,6-dimethyl-4,8-dioxaspiro[2.5]oct-1-ene
SMILESCC1(C)COC2(C=C2)OC1
InChIInChI=1S/C8H12O2/c1-7(2)5-9-8(3-4-8)10-6-7/h3-4H,5-6H2,1-2H3
InChIKeyAINMINDCBBSFAO-UHFFFAOYSA-N
XLogP1.33
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.18
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 71420298
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CID 89099466
3,3,6,6-tetramethyl-2H-pyran
CID 12537905
5,5-dimethyl-2-methylsulfanyl-2-propan-2-yl-1,3-dioxane
CID 146328322
7,7-dimethyl-1,3,5-trioxocane
CID 145482974
3,3-dimethyl-9-[2,3,4-tris(3,3-dimethyl-1,5-dioxaspiro[5.5]undecan-9-ylidene)cyclobutylidene]-1,5-dioxaspiro[5.5]undecane
CID 134981973
9-benzyl-3,3-dimethyl-1,5-dioxaspiro[5.5]undecan-9-ol
CID 118113177
(2R)-6,6-dimethyl-2-(2-phenylethyl)-4,8-dioxaspiro[2.5]octane
CID 101015711
5,5-dimethylspiro[1,3-dioxane-2,4'-naphthalene]-1'-one
CID 11630125
5,5-dimethylspiro[1,3-dioxane-2,2'-3,3a,4,6a-tetrahydro-1H-pentalene]
CID 13247528
2-chloro-2-methyloxirane
CID 15120421

Frequently Asked Questions

What is the IUPAC name of 6,6-dimethyl-4,8-dioxaspiro[2.5]oct-1-ene?
The IUPAC name of 6,6-dimethyl-4,8-dioxaspiro[2.5]oct-1-ene (CID 543319) is 6,6-dimethyl-4,8-dioxaspiro[2.5]oct-1-ene.
What is the SMILES notation for 6,6-dimethyl-4,8-dioxaspiro[2.5]oct-1-ene?
The canonical SMILES for 6,6-dimethyl-4,8-dioxaspiro[2.5]oct-1-ene is CC1(C)COC2(C=C2)OC1.
What is the InChIKey of 6,6-dimethyl-4,8-dioxaspiro[2.5]oct-1-ene?
The InChIKey is AINMINDCBBSFAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12O2/c1-7(2)5-9-8(3-4-8)10-6-7/h3-4H,5-6H2,1-2H3.
What are the key properties of 6,6-dimethyl-4,8-dioxaspiro[2.5]oct-1-ene?
6,6-dimethyl-4,8-dioxaspiro[2.5]oct-1-ene has a molecular weight of 140.18 g/mol, XLogP of 1.33, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-dimethyl-4,8-dioxaspiro[2.5]oct-1-ene is sourced from PubChem (CID 543319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).