1-decylcyclohexan-1-ol

C16H32O — CID 14591140

IUPAC1-decylcyclohexan-1-ol
SMILESCCCCCCCCCCC1(O)CCCCC1
InChIInChI=1S/C16H32O/c1-2-3-4-5-6-7-8-10-13-16(17)14-11-9-12-15-16/h17H,2-15H2,1H3
InChIKeyUKKARDXLNGYDQL-UHFFFAOYSA-N
MW240.43 g/mol
LogP5.21
Rot. Bonds9

About 1-decylcyclohexan-1-ol

1-decylcyclohexan-1-ol (PubChem CID 14591140) has the molecular formula C16H32O and a molecular weight of 240.43 g/mol. Its IUPAC name is 1-decylcyclohexan-1-ol.

Molecular Properties

Compound Name1-decylcyclohexan-1-ol
PubChem CID14591140
Molecular FormulaC16H32O
Molecular Weight240.43 g/mol
Exact Mass240.25
IUPAC Name1-decylcyclohexan-1-ol
SMILESCCCCCCCCCCC1(O)CCCCC1
InChIInChI=1S/C16H32O/c1-2-3-4-5-6-7-8-10-13-16(17)14-11-9-12-15-16/h17H,2-15H2,1H3
InChIKeyUKKARDXLNGYDQL-UHFFFAOYSA-N
XLogP5.21
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500240.43
LogP ≤ 55.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-decylcyclohexan-1-ol?
The IUPAC name of 1-decylcyclohexan-1-ol (CID 14591140) is 1-decylcyclohexan-1-ol.
What is the SMILES notation for 1-decylcyclohexan-1-ol?
The canonical SMILES for 1-decylcyclohexan-1-ol is CCCCCCCCCCC1(O)CCCCC1.
What is the InChIKey of 1-decylcyclohexan-1-ol?
The InChIKey is UKKARDXLNGYDQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O/c1-2-3-4-5-6-7-8-10-13-16(17)14-11-9-12-15-16/h17H,2-15H2,1H3.
What are the key properties of 1-decylcyclohexan-1-ol?
1-decylcyclohexan-1-ol has a molecular weight of 240.43 g/mol, XLogP of 5.21, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-decylcyclohexan-1-ol is sourced from PubChem (CID 14591140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).