(3E,5E)-4-ethenylocta-1,3,5-triene

C10H14 — CID 142003848

IUPAC(3E,5E)-4-ethenylocta-1,3,5-triene
SMILESC=C/C=C(C=C)/C=C/CC
InChIInChI=1S/C10H14/c1-4-7-9-10(6-3)8-5-2/h5-9H,2-4H2,1H3/b9-7+,10-8+
InChIKeyNFLSBAWUIDZURD-FIFLTTCUSA-N
MW134.22 g/mol
LogP3.25
Rot. Bonds4

About (3E,5E)-4-ethenylocta-1,3,5-triene

(3E,5E)-4-ethenylocta-1,3,5-triene (PubChem CID 142003848) has the molecular formula C10H14 and a molecular weight of 134.22 g/mol. Its IUPAC name is (3E,5E)-4-ethenylocta-1,3,5-triene.

Molecular Properties

Compound Name(3E,5E)-4-ethenylocta-1,3,5-triene
PubChem CID142003848
Molecular FormulaC10H14
Molecular Weight134.22 g/mol
Exact Mass134.11
IUPAC Name(3E,5E)-4-ethenylocta-1,3,5-triene
SMILESC=C/C=C(C=C)/C=C/CC
InChIInChI=1S/C10H14/c1-4-7-9-10(6-3)8-5-2/h5-9H,2-4H2,1H3/b9-7+,10-8+
InChIKeyNFLSBAWUIDZURD-FIFLTTCUSA-N
XLogP3.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.22
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (3E,5E)-4-ethenylocta-1,3,5-triene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethane;(3Z,5Z)-4-[(E)-prop-1-enyl]octa-1,3,5-triene
CID 143078245
(3Z)-4-methylocta-1,3,5-triene
CID 142968936
(3Z,6Z)-4-ethenyl-5-methylidenenona-1,3,6-triene
CID 142571328
[(1Z,3E,4Z)-3-prop-2-enylidenehepta-1,4-dienyl]benzene
CID 155701401
(3E,5Z,7Z)-4-ethenylnona-1,3,5,7-tetraene
CID 155698578
(3E,5Z)-octa-1,3,5-triene-4-sulfonic acid
CID 89312576
propane;(5Z)-4-[(E)-prop-1-enyl]hepta-1,3,5-triene
CID 143651334
(2E,4Z)-2-ethenylhepta-2,4-dienal
CID 129060259
(2E,4Z)-4-ethenylhepta-2,4,6-trienal
CID 118145094
(3Z,5Z)-3,4-dichloroocta-1,3,5-triene
CID 88957230
(3Z,6Z,7Z)-6-ethylidene-4-[(Z)-prop-1-enyl]deca-1,3,7-triene
CID 144556498
(3Z,5Z,6Z)-4-[(Z)-prop-1-enyl]-5-propylidenenona-1,3,6-triene
CID 142312550

Frequently Asked Questions

What is the IUPAC name of (3E,5E)-4-ethenylocta-1,3,5-triene?
The IUPAC name of (3E,5E)-4-ethenylocta-1,3,5-triene (CID 142003848) is (3E,5E)-4-ethenylocta-1,3,5-triene.
What is the SMILES notation for (3E,5E)-4-ethenylocta-1,3,5-triene?
The canonical SMILES for (3E,5E)-4-ethenylocta-1,3,5-triene is C=C/C=C(C=C)/C=C/CC.
What is the InChIKey of (3E,5E)-4-ethenylocta-1,3,5-triene?
The InChIKey is NFLSBAWUIDZURD-FIFLTTCUSA-N. The full InChI is InChI=1S/C10H14/c1-4-7-9-10(6-3)8-5-2/h5-9H,2-4H2,1H3/b9-7+,10-8+.
What are the key properties of (3E,5E)-4-ethenylocta-1,3,5-triene?
(3E,5E)-4-ethenylocta-1,3,5-triene has a molecular weight of 134.22 g/mol, XLogP of 3.25, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3E,5E)-4-ethenylocta-1,3,5-triene is sourced from PubChem (CID 142003848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).