10-ethoxydecan-1-ol

C12H26O2 — CID 22412883

IUPAC10-ethoxydecan-1-ol
SMILESCCOCCCCCCCCCCO
InChIInChI=1S/C12H26O2/c1-2-14-12-10-8-6-4-3-5-7-9-11-13/h13H,2-12H2,1H3
InChIKeyDOZNEOXWNODLHF-UHFFFAOYSA-N
MW202.34 g/mol
LogP3.14
Rot. Bonds11

About 10-ethoxydecan-1-ol

10-ethoxydecan-1-ol (PubChem CID 22412883) has the molecular formula C12H26O2 and a molecular weight of 202.34 g/mol. Its IUPAC name is 10-ethoxydecan-1-ol.

Molecular Properties

Compound Name10-ethoxydecan-1-ol
PubChem CID22412883
Molecular FormulaC12H26O2
Molecular Weight202.34 g/mol
Exact Mass202.19
IUPAC Name10-ethoxydecan-1-ol
SMILESCCOCCCCCCCCCCO
InChIInChI=1S/C12H26O2/c1-2-14-12-10-8-6-4-3-5-7-9-11-13/h13H,2-12H2,1H3
InChIKeyDOZNEOXWNODLHF-UHFFFAOYSA-N
XLogP3.14
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 53.14
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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Frequently Asked Questions

What is the IUPAC name of 10-ethoxydecan-1-ol?
The IUPAC name of 10-ethoxydecan-1-ol (CID 22412883) is 10-ethoxydecan-1-ol.
What is the SMILES notation for 10-ethoxydecan-1-ol?
The canonical SMILES for 10-ethoxydecan-1-ol is CCOCCCCCCCCCCO.
What is the InChIKey of 10-ethoxydecan-1-ol?
The InChIKey is DOZNEOXWNODLHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O2/c1-2-14-12-10-8-6-4-3-5-7-9-11-13/h13H,2-12H2,1H3.
What are the key properties of 10-ethoxydecan-1-ol?
10-ethoxydecan-1-ol has a molecular weight of 202.34 g/mol, XLogP of 3.14, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-ethoxydecan-1-ol is sourced from PubChem (CID 22412883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).