(9S)-6-oxaspiro[4.5]decan-9-ol

C9H16O2 — CID 95335752

IUPAC(9S)-6-oxaspiro[4.5]decan-9-ol
SMILESO[C@H]1CCOC2(CCCC2)C1
InChIInChI=1S/C9H16O2/c10-8-3-6-11-9(7-8)4-1-2-5-9/h8,10H,1-7H2/t8-/m0/s1
InChIKeyQSDYJCBYXIBQAG-QMMMGPOBSA-N
MW156.22 g/mol
LogP1.47
Rot. Bonds

About (9S)-6-oxaspiro[4.5]decan-9-ol

(9S)-6-oxaspiro[4.5]decan-9-ol (PubChem CID 95335752) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol. Its IUPAC name is (9S)-6-oxaspiro[4.5]decan-9-ol.

Molecular Properties

Compound Name(9S)-6-oxaspiro[4.5]decan-9-ol
PubChem CID95335752
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Name(9S)-6-oxaspiro[4.5]decan-9-ol
SMILESO[C@H]1CCOC2(CCCC2)C1
InChIInChI=1S/C9H16O2/c10-8-3-6-11-9(7-8)4-1-2-5-9/h8,10H,1-7H2/t8-/m0/s1
InChIKeyQSDYJCBYXIBQAG-QMMMGPOBSA-N
XLogP1.47
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.22
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (9S)-6-oxaspiro[4.5]decan-9-ol?
The IUPAC name of (9S)-6-oxaspiro[4.5]decan-9-ol (CID 95335752) is (9S)-6-oxaspiro[4.5]decan-9-ol.
What is the SMILES notation for (9S)-6-oxaspiro[4.5]decan-9-ol?
The canonical SMILES for (9S)-6-oxaspiro[4.5]decan-9-ol is O[C@H]1CCOC2(CCCC2)C1.
What is the InChIKey of (9S)-6-oxaspiro[4.5]decan-9-ol?
The InChIKey is QSDYJCBYXIBQAG-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H16O2/c10-8-3-6-11-9(7-8)4-1-2-5-9/h8,10H,1-7H2/t8-/m0/s1.
What are the key properties of (9S)-6-oxaspiro[4.5]decan-9-ol?
(9S)-6-oxaspiro[4.5]decan-9-ol has a molecular weight of 156.22 g/mol, XLogP of 1.47, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (9S)-6-oxaspiro[4.5]decan-9-ol is sourced from PubChem (CID 95335752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).