(E)-hexadec-11-en-1-ol

C16H32O — CID 5352278

IUPAC(E)-hexadec-11-en-1-ol
SMILESCCCC/C=C/CCCCCCCCCCO
InChIInChI=1S/C16H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h5-6,17H,2-4,7-16H2,1H3/b6-5+
InChIKeyRHVMNRHQWXIJIS-AATRIKPKSA-N
MW240.43 g/mol
LogP5.24
Rot. Bonds13

About (E)-hexadec-11-en-1-ol

(E)-hexadec-11-en-1-ol (PubChem CID 5352278) has the molecular formula C16H32O and a molecular weight of 240.43 g/mol. Its IUPAC name is (E)-hexadec-11-en-1-ol.

Molecular Properties

Compound Name(E)-hexadec-11-en-1-ol
PubChem CID5352278
Molecular FormulaC16H32O
Molecular Weight240.43 g/mol
Exact Mass240.25
IUPAC Name(E)-hexadec-11-en-1-ol
SMILESCCCC/C=C/CCCCCCCCCCO
InChIInChI=1S/C16H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h5-6,17H,2-4,7-16H2,1H3/b6-5+
InChIKeyRHVMNRHQWXIJIS-AATRIKPKSA-N
XLogP5.24
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500240.43
LogP ≤ 55.24
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 (E)-hexadec-11-en-1-ol?
The IUPAC name of (E)-hexadec-11-en-1-ol (CID 5352278) is (E)-hexadec-11-en-1-ol.
What is the SMILES notation for (E)-hexadec-11-en-1-ol?
The canonical SMILES for (E)-hexadec-11-en-1-ol is CCCC/C=C/CCCCCCCCCCO.
What is the InChIKey of (E)-hexadec-11-en-1-ol?
The InChIKey is RHVMNRHQWXIJIS-AATRIKPKSA-N. The full InChI is InChI=1S/C16H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h5-6,17H,2-4,7-16H2,1H3/b6-5+.
What are the key properties of (E)-hexadec-11-en-1-ol?
(E)-hexadec-11-en-1-ol has a molecular weight of 240.43 g/mol, XLogP of 5.24, 13 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-hexadec-11-en-1-ol is sourced from PubChem (CID 5352278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).