dec-9-en-2-ol

C10H20O — CID 542278

IUPACdec-9-en-2-ol
SMILESC=CCCCCCCC(C)O
InChIInChI=1S/C10H20O/c1-3-4-5-6-7-8-9-10(2)11/h3,10-11H,1,4-9H2,2H3
InChIKeyJBAYWUMDFPCBDF-UHFFFAOYSA-N
MW156.27 g/mol
LogP2.89
Rot. Bonds7

About dec-9-en-2-ol

dec-9-en-2-ol (PubChem CID 542278) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is dec-9-en-2-ol.

Molecular Properties

Compound Namedec-9-en-2-ol
PubChem CID542278
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Namedec-9-en-2-ol
SMILESC=CCCCCCCC(C)O
InChIInChI=1S/C10H20O/c1-3-4-5-6-7-8-9-10(2)11/h3,10-11H,1,4-9H2,2H3
InChIKeyJBAYWUMDFPCBDF-UHFFFAOYSA-N
XLogP2.89
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dec-9-en-2-ol?
The IUPAC name of dec-9-en-2-ol (CID 542278) is dec-9-en-2-ol.
What is the SMILES notation for dec-9-en-2-ol?
The canonical SMILES for dec-9-en-2-ol is C=CCCCCCCC(C)O.
What is the InChIKey of dec-9-en-2-ol?
The InChIKey is JBAYWUMDFPCBDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O/c1-3-4-5-6-7-8-9-10(2)11/h3,10-11H,1,4-9H2,2H3.
What are the key properties of dec-9-en-2-ol?
dec-9-en-2-ol has a molecular weight of 156.27 g/mol, XLogP of 2.89, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dec-9-en-2-ol is sourced from PubChem (CID 542278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).