undecan-1-ol

C11H24O — CID 8184

IUPACundecan-1-ol
SMILESCCCCCCCCCCCO
InChIInChI=1S/C11H24O/c1-2-3-4-5-6-7-8-9-10-11-12/h12H,2-11H2,1H3
InChIKeyKJIOQYGWTQBHNH-UHFFFAOYSA-N
MW172.31 g/mol
LogP3.51
Rot. Bonds9

About undecan-1-ol

undecan-1-ol (PubChem CID 8184) has the molecular formula C11H24O and a molecular weight of 172.31 g/mol. Its IUPAC name is undecan-1-ol.

Molecular Properties

Compound Nameundecan-1-ol
PubChem CID8184
Molecular FormulaC11H24O
Molecular Weight172.31 g/mol
Exact Mass172.18
IUPAC Nameundecan-1-ol
SMILESCCCCCCCCCCCO
InChIInChI=1S/C11H24O/c1-2-3-4-5-6-7-8-9-10-11-12/h12H,2-11H2,1H3
InChIKeyKJIOQYGWTQBHNH-UHFFFAOYSA-N
XLogP3.51
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.31
LogP ≤ 53.51
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 undecan-1-ol?
The IUPAC name of undecan-1-ol (CID 8184) is undecan-1-ol.
What is the SMILES notation for undecan-1-ol?
The canonical SMILES for undecan-1-ol is CCCCCCCCCCCO.
What is the InChIKey of undecan-1-ol?
The InChIKey is KJIOQYGWTQBHNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O/c1-2-3-4-5-6-7-8-9-10-11-12/h12H,2-11H2,1H3.
What are the key properties of undecan-1-ol?
undecan-1-ol has a molecular weight of 172.31 g/mol, XLogP of 3.51, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for undecan-1-ol is sourced from PubChem (CID 8184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).