(5E,7E)-pentadeca-5,7-diene

C15H28 — CID 14270937

IUPAC(5E,7E)-pentadeca-5,7-diene
SMILESCCCC/C=C/C=C/CCCCCCC
InChIInChI=1S/C15H28/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h9,11,13,15H,3-8,10,12,14H2,1-2H3/b11-9+,15-13+
InChIKeyWHPGYDMDNJPHBN-PXELCPQFSA-N
MW208.39 g/mol
LogP5.65
Rot. Bonds10

About (5E,7E)-pentadeca-5,7-diene

(5E,7E)-pentadeca-5,7-diene (PubChem CID 14270937) has the molecular formula C15H28 and a molecular weight of 208.39 g/mol. Its IUPAC name is (5E,7E)-pentadeca-5,7-diene.

Molecular Properties

Compound Name(5E,7E)-pentadeca-5,7-diene
PubChem CID14270937
Molecular FormulaC15H28
Molecular Weight208.39 g/mol
Exact Mass208.22
IUPAC Name(5E,7E)-pentadeca-5,7-diene
SMILESCCCC/C=C/C=C/CCCCCCC
InChIInChI=1S/C15H28/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h9,11,13,15H,3-8,10,12,14H2,1-2H3/b11-9+,15-13+
InChIKeyWHPGYDMDNJPHBN-PXELCPQFSA-N
XLogP5.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500208.39
LogP ≤ 55.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (5E,7E)-pentadeca-5,7-diene?
The IUPAC name of (5E,7E)-pentadeca-5,7-diene (CID 14270937) is (5E,7E)-pentadeca-5,7-diene.
What is the SMILES notation for (5E,7E)-pentadeca-5,7-diene?
The canonical SMILES for (5E,7E)-pentadeca-5,7-diene is CCCC/C=C/C=C/CCCCCCC.
What is the InChIKey of (5E,7E)-pentadeca-5,7-diene?
The InChIKey is WHPGYDMDNJPHBN-PXELCPQFSA-N. The full InChI is InChI=1S/C15H28/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h9,11,13,15H,3-8,10,12,14H2,1-2H3/b11-9+,15-13+.
What are the key properties of (5E,7E)-pentadeca-5,7-diene?
(5E,7E)-pentadeca-5,7-diene has a molecular weight of 208.39 g/mol, XLogP of 5.65, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5E,7E)-pentadeca-5,7-diene is sourced from PubChem (CID 14270937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).