(3S,5Z)-undeca-1,5-dien-3-ol

C11H20O — CID 6444073

IUPAC(3S,5Z)-undeca-1,5-dien-3-ol
SMILESC=C[C@@H](O)C/C=C\CCCCC
InChIInChI=1S/C11H20O/c1-3-5-6-7-8-9-10-11(12)4-2/h4,8-9,11-12H,2-3,5-7,10H2,1H3/b9-8-/t11-/m1/s1
InChIKeyJYWXEBALSPBIIA-TYBABMIJSA-N
MW168.28 g/mol
LogP3.06
Rot. Bonds7

About (3S,5Z)-undeca-1,5-dien-3-ol

(3S,5Z)-undeca-1,5-dien-3-ol (PubChem CID 6444073) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is (3S,5Z)-undeca-1,5-dien-3-ol.

Molecular Properties

Compound Name(3S,5Z)-undeca-1,5-dien-3-ol
PubChem CID6444073
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name(3S,5Z)-undeca-1,5-dien-3-ol
SMILESC=C[C@@H](O)C/C=C\CCCCC
InChIInChI=1S/C11H20O/c1-3-5-6-7-8-9-10-11(12)4-2/h4,8-9,11-12H,2-3,5-7,10H2,1H3/b9-8-/t11-/m1/s1
InChIKeyJYWXEBALSPBIIA-TYBABMIJSA-N
XLogP3.06
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 53.06
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 (3S,5Z)-undeca-1,5-dien-3-ol?
The IUPAC name of (3S,5Z)-undeca-1,5-dien-3-ol (CID 6444073) is (3S,5Z)-undeca-1,5-dien-3-ol.
What is the SMILES notation for (3S,5Z)-undeca-1,5-dien-3-ol?
The canonical SMILES for (3S,5Z)-undeca-1,5-dien-3-ol is C=C[C@@H](O)C/C=C\CCCCC.
What is the InChIKey of (3S,5Z)-undeca-1,5-dien-3-ol?
The InChIKey is JYWXEBALSPBIIA-TYBABMIJSA-N. The full InChI is InChI=1S/C11H20O/c1-3-5-6-7-8-9-10-11(12)4-2/h4,8-9,11-12H,2-3,5-7,10H2,1H3/b9-8-/t11-/m1/s1.
What are the key properties of (3S,5Z)-undeca-1,5-dien-3-ol?
(3S,5Z)-undeca-1,5-dien-3-ol has a molecular weight of 168.28 g/mol, XLogP of 3.06, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3S,5Z)-undeca-1,5-dien-3-ol is sourced from PubChem (CID 6444073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).