(E)-5-methylnon-2-en-5-ol

C10H20O — CID 20707131

IUPAC(E)-5-methylnon-2-en-5-ol
SMILESC/C=C/CC(C)(O)CCCC
InChIInChI=1S/C10H20O/c1-4-6-8-10(3,11)9-7-5-2/h4,6,11H,5,7-9H2,1-3H3/b6-4+
InChIKeyQPJICRLSBMKKMY-GQCTYLIASA-N
MW156.27 g/mol
LogP2.89
Rot. Bonds5

About (E)-5-methylnon-2-en-5-ol

(E)-5-methylnon-2-en-5-ol (PubChem CID 20707131) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is (E)-5-methylnon-2-en-5-ol.

Molecular Properties

Compound Name(E)-5-methylnon-2-en-5-ol
PubChem CID20707131
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name(E)-5-methylnon-2-en-5-ol
SMILESC/C=C/CC(C)(O)CCCC
InChIInChI=1S/C10H20O/c1-4-6-8-10(3,11)9-7-5-2/h4,6,11H,5,7-9H2,1-3H3/b6-4+
InChIKeyQPJICRLSBMKKMY-GQCTYLIASA-N
XLogP2.89
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
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': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-5-methylnon-2-en-5-ol?
The IUPAC name of (E)-5-methylnon-2-en-5-ol (CID 20707131) is (E)-5-methylnon-2-en-5-ol.
What is the SMILES notation for (E)-5-methylnon-2-en-5-ol?
The canonical SMILES for (E)-5-methylnon-2-en-5-ol is C/C=C/CC(C)(O)CCCC.
What is the InChIKey of (E)-5-methylnon-2-en-5-ol?
The InChIKey is QPJICRLSBMKKMY-GQCTYLIASA-N. The full InChI is InChI=1S/C10H20O/c1-4-6-8-10(3,11)9-7-5-2/h4,6,11H,5,7-9H2,1-3H3/b6-4+.
What are the key properties of (E)-5-methylnon-2-en-5-ol?
(E)-5-methylnon-2-en-5-ol has a molecular weight of 156.27 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-5-methylnon-2-en-5-ol is sourced from PubChem (CID 20707131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).