3-ethenyl-8,8-dimethyl-7,9-dioxaspiro[4.5]dec-2-ene

C12H18O2 — CID 11333029

IUPAC3-ethenyl-8,8-dimethyl-7,9-dioxaspiro[4.5]dec-2-ene
SMILESC=CC1=CCC2(COC(C)(C)OC2)C1
InChIInChI=1S/C12H18O2/c1-4-10-5-6-12(7-10)8-13-11(2,3)14-9-12/h4-5H,1,6-9H2,2-3H3
InChIKeyRWJLCPKJOKROSN-UHFFFAOYSA-N
MW194.27 g/mol
LogP2.66
Rot. Bonds1

About 3-ethenyl-8,8-dimethyl-7,9-dioxaspiro[4.5]dec-2-ene

3-ethenyl-8,8-dimethyl-7,9-dioxaspiro[4.5]dec-2-ene (PubChem CID 11333029) has the molecular formula C12H18O2 and a molecular weight of 194.27 g/mol. Its IUPAC name is 3-ethenyl-8,8-dimethyl-7,9-dioxaspiro[4.5]dec-2-ene.

Molecular Properties

Compound Name3-ethenyl-8,8-dimethyl-7,9-dioxaspiro[4.5]dec-2-ene
PubChem CID11333029
Molecular FormulaC12H18O2
Molecular Weight194.27 g/mol
Exact Mass194.13
IUPAC Name3-ethenyl-8,8-dimethyl-7,9-dioxaspiro[4.5]dec-2-ene
SMILESC=CC1=CCC2(COC(C)(C)OC2)C1
InChIInChI=1S/C12H18O2/c1-4-10-5-6-12(7-10)8-13-11(2,3)14-9-12/h4-5H,1,6-9H2,2-3H3
InChIKeyRWJLCPKJOKROSN-UHFFFAOYSA-N
XLogP2.66
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.27
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-Dioxaspiro[5.5]undec-8-ene, 3-ethyl-
CID 116562
3,3-Dimethyl-2,4-dioxaspiro[5.5]undec-9-ene
CID 20307661
7-Ethenyl-6,6-dimethyl-1,4-dioxaspiro[4.5]dec-7-ene
CID 10679352
10-tert-butyl-3,3-dimethyl-8-methylidene-9-[(E)-prop-1-enyl]-2,4-dioxaspiro[5.5]undec-9-ene
CID 11066209
CID 11069704
CID 11069704
5-Allyl-2,2-dimethyl-5-(3-methylbut-2-en-1-yl)-1,3-dioxane
CID 101415255
CID 102036286
CID 102036286
5-(2,5-Dihydrofuran-3-ylmethyl)-2,2-dimethyl-5-prop-2-enyl-1,3-dioxane
CID 134854473
2-Methyl-2-(1-methylcyclohex-3-en-1-yl)-1,3-dioxolane
CID 134993895
8,8-Dimethyl-7,9-dioxaspiro[4.5]dec-2-ene
CID 71359301
3-Butyl-2,4-dioxaspiro[5.5]undec-9-ene
CID 20307638
3,3,11-Trimethyl-2,4-dioxaspiro[5.5]undec-8-ene
CID 20307640

Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-8,8-dimethyl-7,9-dioxaspiro[4.5]dec-2-ene?
The IUPAC name of 3-ethenyl-8,8-dimethyl-7,9-dioxaspiro[4.5]dec-2-ene (CID 11333029) is 3-ethenyl-8,8-dimethyl-7,9-dioxaspiro[4.5]dec-2-ene.
What is the SMILES notation for 3-ethenyl-8,8-dimethyl-7,9-dioxaspiro[4.5]dec-2-ene?
The canonical SMILES for 3-ethenyl-8,8-dimethyl-7,9-dioxaspiro[4.5]dec-2-ene is C=CC1=CCC2(COC(C)(C)OC2)C1.
What is the InChIKey of 3-ethenyl-8,8-dimethyl-7,9-dioxaspiro[4.5]dec-2-ene?
The InChIKey is RWJLCPKJOKROSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O2/c1-4-10-5-6-12(7-10)8-13-11(2,3)14-9-12/h4-5H,1,6-9H2,2-3H3.
What are the key properties of 3-ethenyl-8,8-dimethyl-7,9-dioxaspiro[4.5]dec-2-ene?
3-ethenyl-8,8-dimethyl-7,9-dioxaspiro[4.5]dec-2-ene has a molecular weight of 194.27 g/mol, XLogP of 2.66, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-8,8-dimethyl-7,9-dioxaspiro[4.5]dec-2-ene is sourced from PubChem (CID 11333029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).