5-oxaspiro[3.5]nonan-8-ylmethanol

C9H16O2 — CID 79913592

IUPAC5-oxaspiro[3.5]nonan-8-ylmethanol
SMILESOCC1CCOC2(CCC2)C1
InChIInChI=1S/C9H16O2/c10-7-8-2-5-11-9(6-8)3-1-4-9/h8,10H,1-7H2
InChIKeyQZLKWBKONMBIEU-UHFFFAOYSA-N
MW156.22 g/mol
LogP1.33
Rot. Bonds1

About 5-oxaspiro[3.5]nonan-8-ylmethanol

5-oxaspiro[3.5]nonan-8-ylmethanol (PubChem CID 79913592) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol. Its IUPAC name is 5-oxaspiro[3.5]nonan-8-ylmethanol.

Molecular Properties

Compound Name5-oxaspiro[3.5]nonan-8-ylmethanol
PubChem CID79913592
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Name5-oxaspiro[3.5]nonan-8-ylmethanol
SMILESOCC1CCOC2(CCC2)C1
InChIInChI=1S/C9H16O2/c10-7-8-2-5-11-9(6-8)3-1-4-9/h8,10H,1-7H2
InChIKeyQZLKWBKONMBIEU-UHFFFAOYSA-N
XLogP1.33
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.22
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-oxaspiro[3.5]nonan-8-ylmethanol?
The IUPAC name of 5-oxaspiro[3.5]nonan-8-ylmethanol (CID 79913592) is 5-oxaspiro[3.5]nonan-8-ylmethanol.
What is the SMILES notation for 5-oxaspiro[3.5]nonan-8-ylmethanol?
The canonical SMILES for 5-oxaspiro[3.5]nonan-8-ylmethanol is OCC1CCOC2(CCC2)C1.
What is the InChIKey of 5-oxaspiro[3.5]nonan-8-ylmethanol?
The InChIKey is QZLKWBKONMBIEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O2/c10-7-8-2-5-11-9(6-8)3-1-4-9/h8,10H,1-7H2.
What are the key properties of 5-oxaspiro[3.5]nonan-8-ylmethanol?
5-oxaspiro[3.5]nonan-8-ylmethanol has a molecular weight of 156.22 g/mol, XLogP of 1.33, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxaspiro[3.5]nonan-8-ylmethanol is sourced from PubChem (CID 79913592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).