dec-5-en-4-ol

C10H20O — CID 57109614

IUPACdec-5-en-4-ol
SMILESCCCCC=CC(O)CCC
InChIInChI=1S/C10H20O/c1-3-5-6-7-9-10(11)8-4-2/h7,9-11H,3-6,8H2,1-2H3
InChIKeyNBPPKTKYXZJMLD-UHFFFAOYSA-N
MW156.27 g/mol
LogP2.89
Rot. Bonds6

About dec-5-en-4-ol

dec-5-en-4-ol (PubChem CID 57109614) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is dec-5-en-4-ol.

Molecular Properties

Compound Namedec-5-en-4-ol
PubChem CID57109614
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Namedec-5-en-4-ol
SMILESCCCCC=CC(O)CCC
InChIInChI=1S/C10H20O/c1-3-5-6-7-9-10(11)8-4-2/h7,9-11H,3-6,8H2,1-2H3
InChIKeyNBPPKTKYXZJMLD-UHFFFAOYSA-N
XLogP2.89
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
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-5-en-4-ol?
The IUPAC name of dec-5-en-4-ol (CID 57109614) is dec-5-en-4-ol.
What is the SMILES notation for dec-5-en-4-ol?
The canonical SMILES for dec-5-en-4-ol is CCCCC=CC(O)CCC.
What is the InChIKey of dec-5-en-4-ol?
The InChIKey is NBPPKTKYXZJMLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O/c1-3-5-6-7-9-10(11)8-4-2/h7,9-11H,3-6,8H2,1-2H3.
What are the key properties of dec-5-en-4-ol?
dec-5-en-4-ol has a molecular weight of 156.27 g/mol, XLogP of 2.89, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dec-5-en-4-ol is sourced from PubChem (CID 57109614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).