2,6,6,10-tetramethyl-1-oxaspiro[4.5]deca-2,9-diene

C13H20O — CID 14086370

IUPAC2,6,6,10-tetramethyl-1-oxaspiro[4.5]deca-2,9-diene
SMILESCC1=CCC2(O1)C(C)=CCCC2(C)C
InChIInChI=1S/C13H20O/c1-10-6-5-8-12(3,4)13(10)9-7-11(2)14-13/h6-7H,5,8-9H2,1-4H3
InChIKeyDRDYZZIBFWGGGH-UHFFFAOYSA-N
MW192.30 g/mol
LogP3.82
Rot. Bonds

About 2,6,6,10-tetramethyl-1-oxaspiro[4.5]deca-2,9-diene

2,6,6,10-tetramethyl-1-oxaspiro[4.5]deca-2,9-diene (PubChem CID 14086370) has the molecular formula C13H20O and a molecular weight of 192.30 g/mol. Its IUPAC name is 2,6,6,10-tetramethyl-1-oxaspiro[4.5]deca-2,9-diene.

Molecular Properties

Compound Name2,6,6,10-tetramethyl-1-oxaspiro[4.5]deca-2,9-diene
PubChem CID14086370
Molecular FormulaC13H20O
Molecular Weight192.30 g/mol
Exact Mass192.15
IUPAC Name2,6,6,10-tetramethyl-1-oxaspiro[4.5]deca-2,9-diene
SMILESCC1=CCC2(O1)C(C)=CCCC2(C)C
InChIInChI=1S/C13H20O/c1-10-6-5-8-12(3,4)13(10)9-7-11(2)14-13/h6-7H,5,8-9H2,1-4H3
InChIKeyDRDYZZIBFWGGGH-UHFFFAOYSA-N
XLogP3.82
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.30
LogP ≤ 53.82
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 2,6,6,10-tetramethyl-1-oxaspiro[4.5]deca-2,9-diene?
The IUPAC name of 2,6,6,10-tetramethyl-1-oxaspiro[4.5]deca-2,9-diene (CID 14086370) is 2,6,6,10-tetramethyl-1-oxaspiro[4.5]deca-2,9-diene.
What is the SMILES notation for 2,6,6,10-tetramethyl-1-oxaspiro[4.5]deca-2,9-diene?
The canonical SMILES for 2,6,6,10-tetramethyl-1-oxaspiro[4.5]deca-2,9-diene is CC1=CCC2(O1)C(C)=CCCC2(C)C.
What is the InChIKey of 2,6,6,10-tetramethyl-1-oxaspiro[4.5]deca-2,9-diene?
The InChIKey is DRDYZZIBFWGGGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O/c1-10-6-5-8-12(3,4)13(10)9-7-11(2)14-13/h6-7H,5,8-9H2,1-4H3.
What are the key properties of 2,6,6,10-tetramethyl-1-oxaspiro[4.5]deca-2,9-diene?
2,6,6,10-tetramethyl-1-oxaspiro[4.5]deca-2,9-diene has a molecular weight of 192.30 g/mol, XLogP of 3.82, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6,6,10-tetramethyl-1-oxaspiro[4.5]deca-2,9-diene is sourced from PubChem (CID 14086370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).