(E)-hexadec-8-ene

C16H32 — CID 5352969

IUPAC(E)-hexadec-8-ene
SMILESCCCCCCC/C=C/CCCCCCC
InChIInChI=1S/C16H32/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h15-16H,3-14H2,1-2H3/b16-15+
InChIKeyKWEAIXVWPDMXCR-FOCLMDBBSA-N
MW224.43 g/mol
LogP6.26
Rot. Bonds12

About (E)-hexadec-8-ene

(E)-hexadec-8-ene (PubChem CID 5352969) has the molecular formula C16H32 and a molecular weight of 224.43 g/mol. Its IUPAC name is (E)-hexadec-8-ene.

Molecular Properties

Compound Name(E)-hexadec-8-ene
PubChem CID5352969
Molecular FormulaC16H32
Molecular Weight224.43 g/mol
Exact Mass224.25
IUPAC Name(E)-hexadec-8-ene
SMILESCCCCCCC/C=C/CCCCCCC
InChIInChI=1S/C16H32/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h15-16H,3-14H2,1-2H3/b16-15+
InChIKeyKWEAIXVWPDMXCR-FOCLMDBBSA-N
XLogP6.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500224.43
LogP ≤ 56.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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-8-ene?
The IUPAC name of (E)-hexadec-8-ene (CID 5352969) is (E)-hexadec-8-ene.
What is the SMILES notation for (E)-hexadec-8-ene?
The canonical SMILES for (E)-hexadec-8-ene is CCCCCCC/C=C/CCCCCCC.
What is the InChIKey of (E)-hexadec-8-ene?
The InChIKey is KWEAIXVWPDMXCR-FOCLMDBBSA-N. The full InChI is InChI=1S/C16H32/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h15-16H,3-14H2,1-2H3/b16-15+.
What are the key properties of (E)-hexadec-8-ene?
(E)-hexadec-8-ene has a molecular weight of 224.43 g/mol, XLogP of 6.26, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-hexadec-8-ene is sourced from PubChem (CID 5352969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).