7-ethenyl-6,6-dimethyl-1,4-dioxaspiro[4.5]dec-7-ene

C12H18O2 — CID 10679352

IUPAC7-ethenyl-6,6-dimethyl-1,4-dioxaspiro[4.5]dec-7-ene
SMILESC=CC1=CCCC2(OCCO2)C1(C)C
InChIInChI=1S/C12H18O2/c1-4-10-6-5-7-12(11(10,2)3)13-8-9-14-12/h4,6H,1,5,7-9H2,2-3H3
InChIKeyRGYMIGODSCCMIE-UHFFFAOYSA-N
MW194.27 g/mol
LogP2.66
Rot. Bonds1

About 7-ethenyl-6,6-dimethyl-1,4-dioxaspiro[4.5]dec-7-ene

7-ethenyl-6,6-dimethyl-1,4-dioxaspiro[4.5]dec-7-ene (PubChem CID 10679352) has the molecular formula C12H18O2 and a molecular weight of 194.27 g/mol. Its IUPAC name is 7-ethenyl-6,6-dimethyl-1,4-dioxaspiro[4.5]dec-7-ene.

Molecular Properties

Compound Name7-ethenyl-6,6-dimethyl-1,4-dioxaspiro[4.5]dec-7-ene
PubChem CID10679352
Molecular FormulaC12H18O2
Molecular Weight194.27 g/mol
Exact Mass194.13
IUPAC Name7-ethenyl-6,6-dimethyl-1,4-dioxaspiro[4.5]dec-7-ene
SMILESC=CC1=CCCC2(OCCO2)C1(C)C
InChIInChI=1S/C12H18O2/c1-4-10-6-5-7-12(11(10,2)3)13-8-9-14-12/h4,6H,1,5,7-9H2,2-3H3
InChIKeyRGYMIGODSCCMIE-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

7-Vinyl-1,4-dioxaspiro[4.5]dec-7-ene
CID 91801305
1,3-Dioxolane, 2-(2,3-dimethyl-1-cyclopenten-3-yl)-2,4,5-trimethyl-
CID 575288
1,4-Dioxaspiro[4.5]dec-7-ene, 8-ethenyl-
CID 10866700
1,4-Dioxaspiro[4.5]dec-7-ene, 7,9,9-trimethyl-
CID 10910189
7-Ethenyl-8-methyl-1,4-dioxaspiro[4.5]dec-7-ene
CID 13023903
2-Methyl-2-(1,2,3-trimethylcyclohex-3-en-1-yl)-1,3-dioxolane
CID 134979641
2-methyl-2-[(1R,6R)-1,4,6-trimethylcyclohex-3-en-1-yl]-1,3-dioxolane
CID 134979642
2-methyl-2-[(1S,6R)-1,2,6-trimethylcyclohex-3-en-1-yl]-1,3-dioxolane
CID 134980022
2-Methyl-2-(1,2,4-trimethylcyclohex-3-en-1-yl)-1,3-dioxolane
CID 134980617
2-methyl-2-[(1S,6R)-1,2,4,6-tetramethylcyclohex-3-en-1-yl]-1,3-dioxolane
CID 134991156
2-methyl-2-[(1S,6R)-1,2,3,6-tetramethylcyclohex-3-en-1-yl]-1,3-dioxolane
CID 134991349
2-[(1R,6R)-1,6-dimethylcyclohex-3-en-1-yl]-2-methyl-1,3-dioxolane
CID 134991928

Frequently Asked Questions

What is the IUPAC name of 7-ethenyl-6,6-dimethyl-1,4-dioxaspiro[4.5]dec-7-ene?
The IUPAC name of 7-ethenyl-6,6-dimethyl-1,4-dioxaspiro[4.5]dec-7-ene (CID 10679352) is 7-ethenyl-6,6-dimethyl-1,4-dioxaspiro[4.5]dec-7-ene.
What is the SMILES notation for 7-ethenyl-6,6-dimethyl-1,4-dioxaspiro[4.5]dec-7-ene?
The canonical SMILES for 7-ethenyl-6,6-dimethyl-1,4-dioxaspiro[4.5]dec-7-ene is C=CC1=CCCC2(OCCO2)C1(C)C.
What is the InChIKey of 7-ethenyl-6,6-dimethyl-1,4-dioxaspiro[4.5]dec-7-ene?
The InChIKey is RGYMIGODSCCMIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O2/c1-4-10-6-5-7-12(11(10,2)3)13-8-9-14-12/h4,6H,1,5,7-9H2,2-3H3.
What are the key properties of 7-ethenyl-6,6-dimethyl-1,4-dioxaspiro[4.5]dec-7-ene?
7-ethenyl-6,6-dimethyl-1,4-dioxaspiro[4.5]dec-7-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 7-ethenyl-6,6-dimethyl-1,4-dioxaspiro[4.5]dec-7-ene is sourced from PubChem (CID 10679352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).