1-(6-oxaspiro[4.5]decan-9-yl)hexan-1-ol

C15H28O2 — CID 79912927

IUPAC1-(6-oxaspiro[4.5]decan-9-yl)hexan-1-ol
SMILESCCCCCC(O)C1CCOC2(CCCC2)C1
InChIInChI=1S/C15H28O2/c1-2-3-4-7-14(16)13-8-11-17-15(12-13)9-5-6-10-15/h13-14,16H,2-12H2,1H3
InChIKeyTZIYZBBJJIEYJX-UHFFFAOYSA-N
MW240.39 g/mol
LogP3.67
Rot. Bonds5

About 1-(6-oxaspiro[4.5]decan-9-yl)hexan-1-ol

1-(6-oxaspiro[4.5]decan-9-yl)hexan-1-ol (PubChem CID 79912927) has the molecular formula C15H28O2 and a molecular weight of 240.39 g/mol. Its IUPAC name is 1-(6-oxaspiro[4.5]decan-9-yl)hexan-1-ol.

Molecular Properties

Compound Name1-(6-oxaspiro[4.5]decan-9-yl)hexan-1-ol
PubChem CID79912927
Molecular FormulaC15H28O2
Molecular Weight240.39 g/mol
Exact Mass240.21
IUPAC Name1-(6-oxaspiro[4.5]decan-9-yl)hexan-1-ol
SMILESCCCCCC(O)C1CCOC2(CCCC2)C1
InChIInChI=1S/C15H28O2/c1-2-3-4-7-14(16)13-8-11-17-15(12-13)9-5-6-10-15/h13-14,16H,2-12H2,1H3
InChIKeyTZIYZBBJJIEYJX-UHFFFAOYSA-N
XLogP3.67
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(6-oxaspiro[4.5]decan-9-yl)heptan-1-ol
CID 79913392
1-(6-oxaspiro[4.5]decan-9-yl)octan-1-amine
CID 105016795
3-cyclopentyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-ol
CID 115823243
1-(6-oxaspiro[4.5]decan-9-yl)-2-(propylamino)ethanol
CID 79924322
2-methyl-1-(1-oxaspiro[5.5]undecan-4-yl)pentan-1-ol
CID 79913855
1-(5-oxaspiro[3.5]nonan-8-yl)octylhydrazine
CID 105322193
1-(5-oxaspiro[3.5]nonan-8-yl)-2-propylsulfanylethanol
CID 79921106
1-(1-oxaspiro[5.5]undecan-4-yl)butan-1-amine
CID 79914693
1-(1-oxaspiro[5.5]undecan-4-yl)-N-propylpentan-1-amine
CID 79911364
1-(5-oxaspiro[3.5]nonan-8-yl)butane-1,2-diol
CID 103454715
1-(1,9-dioxaspiro[5.5]undecan-4-yl)octan-1-amine
CID 105012097
2-methyl-1-(1-oxaspiro[5.5]undecan-4-yl)propan-1-ol
CID 79901248

Frequently Asked Questions

What is the IUPAC name of 1-(6-oxaspiro[4.5]decan-9-yl)hexan-1-ol?
The IUPAC name of 1-(6-oxaspiro[4.5]decan-9-yl)hexan-1-ol (CID 79912927) is 1-(6-oxaspiro[4.5]decan-9-yl)hexan-1-ol.
What is the SMILES notation for 1-(6-oxaspiro[4.5]decan-9-yl)hexan-1-ol?
The canonical SMILES for 1-(6-oxaspiro[4.5]decan-9-yl)hexan-1-ol is CCCCCC(O)C1CCOC2(CCCC2)C1.
What is the InChIKey of 1-(6-oxaspiro[4.5]decan-9-yl)hexan-1-ol?
The InChIKey is TZIYZBBJJIEYJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O2/c1-2-3-4-7-14(16)13-8-11-17-15(12-13)9-5-6-10-15/h13-14,16H,2-12H2,1H3.
What are the key properties of 1-(6-oxaspiro[4.5]decan-9-yl)hexan-1-ol?
1-(6-oxaspiro[4.5]decan-9-yl)hexan-1-ol has a molecular weight of 240.39 g/mol, XLogP of 3.67, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-oxaspiro[4.5]decan-9-yl)hexan-1-ol is sourced from PubChem (CID 79912927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).