decan-1-ol

C10H22O — CID 8174

IUPACdecan-1-ol
SMILESCCCCCCCCCCO
InChIInChI=1S/C10H22O/c1-2-3-4-5-6-7-8-9-10-11/h11H,2-10H2,1H3
InChIKeyMWKFXSUHUHTGQN-UHFFFAOYSA-N
MW158.28 g/mol
LogP3.12
Rot. Bonds8

About decan-1-ol

decan-1-ol (PubChem CID 8174) has the molecular formula C10H22O and a molecular weight of 158.28 g/mol. Its IUPAC name is decan-1-ol.

Molecular Properties

Compound Namedecan-1-ol
PubChem CID8174
Molecular FormulaC10H22O
Molecular Weight158.28 g/mol
Exact Mass158.17
IUPAC Namedecan-1-ol
SMILESCCCCCCCCCCO
InChIInChI=1S/C10H22O/c1-2-3-4-5-6-7-8-9-10-11/h11H,2-10H2,1H3
InChIKeyMWKFXSUHUHTGQN-UHFFFAOYSA-N
XLogP3.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.28
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze decan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-Octanol
CID 957
1-Dodecanol
CID 8193
1-Tetradecanol
CID 8209
Behenyl Alcohol
CID 12620
Stearyl Alcohol
CID 8221
Cetyl Alcohol
CID 2682
2-Octanol
CID 20083
Heptanol
CID 8129
1-Tridecanol
CID 8207
1-Undecanol
CID 8184
1-Nonanol
CID 8914
1-Heptadecanol
CID 15076

Frequently Asked Questions

What is the IUPAC name of decan-1-ol?
The IUPAC name of decan-1-ol (CID 8174) is decan-1-ol.
What is the SMILES notation for decan-1-ol?
The canonical SMILES for decan-1-ol is CCCCCCCCCCO.
What is the InChIKey of decan-1-ol?
The InChIKey is MWKFXSUHUHTGQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O/c1-2-3-4-5-6-7-8-9-10-11/h11H,2-10H2,1H3.
What are the key properties of decan-1-ol?
decan-1-ol has a molecular weight of 158.28 g/mol, XLogP of 3.12, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for decan-1-ol is sourced from PubChem (CID 8174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).