(6R)-1-oxaspiro[5.5]undeca-3,9-diene

C10H14O — CID 101200208

IUPAC(6R)-1-oxaspiro[5.5]undeca-3,9-diene
SMILESC1=CC[C@@]2(CC=CCO2)CC1
InChIInChI=1S/C10H14O/c1-2-6-10(7-3-1)8-4-5-9-11-10/h1-2,4-5H,3,6-9H2/t10-/m0/s1
InChIKeyMXITWHSBQGYVGU-JTQLQIEISA-N
MW150.22 g/mol
LogP2.44
Rot. Bonds

About (6R)-1-oxaspiro[5.5]undeca-3,9-diene

(6R)-1-oxaspiro[5.5]undeca-3,9-diene (PubChem CID 101200208) has the molecular formula C10H14O and a molecular weight of 150.22 g/mol. Its IUPAC name is (6R)-1-oxaspiro[5.5]undeca-3,9-diene.

Molecular Properties

Compound Name(6R)-1-oxaspiro[5.5]undeca-3,9-diene
PubChem CID101200208
Molecular FormulaC10H14O
Molecular Weight150.22 g/mol
Exact Mass150.10
IUPAC Name(6R)-1-oxaspiro[5.5]undeca-3,9-diene
SMILESC1=CC[C@@]2(CC=CCO2)CC1
InChIInChI=1S/C10H14O/c1-2-6-10(7-3-1)8-4-5-9-11-10/h1-2,4-5H,3,6-9H2/t10-/m0/s1
InChIKeyMXITWHSBQGYVGU-JTQLQIEISA-N
XLogP2.44
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 52.44
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 (6R)-1-oxaspiro[5.5]undeca-3,9-diene?
The IUPAC name of (6R)-1-oxaspiro[5.5]undeca-3,9-diene (CID 101200208) is (6R)-1-oxaspiro[5.5]undeca-3,9-diene.
What is the SMILES notation for (6R)-1-oxaspiro[5.5]undeca-3,9-diene?
The canonical SMILES for (6R)-1-oxaspiro[5.5]undeca-3,9-diene is C1=CC[C@@]2(CC=CCO2)CC1.
What is the InChIKey of (6R)-1-oxaspiro[5.5]undeca-3,9-diene?
The InChIKey is MXITWHSBQGYVGU-JTQLQIEISA-N. The full InChI is InChI=1S/C10H14O/c1-2-6-10(7-3-1)8-4-5-9-11-10/h1-2,4-5H,3,6-9H2/t10-/m0/s1.
What are the key properties of (6R)-1-oxaspiro[5.5]undeca-3,9-diene?
(6R)-1-oxaspiro[5.5]undeca-3,9-diene has a molecular weight of 150.22 g/mol, XLogP of 2.44, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-1-oxaspiro[5.5]undeca-3,9-diene is sourced from PubChem (CID 101200208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).