(6E,10Z,14E)-icosa-6,10,14-triene

C20H36 — CID 53230462

IUPAC(6E,10Z,14E)-icosa-6,10,14-triene
SMILESCCCCC/C=C/CC/C=C\CC/C=C/CCCCC
InChIInChI=1S/C20H36/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h11-14,19-20H,3-10,15-18H2,1-2H3/b13-11+,14-12+,20-19-
InChIKeyWTNISNHDOSVBEL-LICCHUDCSA-N
MW276.51 g/mol
LogP7.38
Rot. Bonds14

About (6E,10Z,14E)-icosa-6,10,14-triene

(6E,10Z,14E)-icosa-6,10,14-triene (PubChem CID 53230462) has the molecular formula C20H36 and a molecular weight of 276.51 g/mol. Its IUPAC name is (6E,10Z,14E)-icosa-6,10,14-triene.

Molecular Properties

Compound Name(6E,10Z,14E)-icosa-6,10,14-triene
PubChem CID53230462
Molecular FormulaC20H36
Molecular Weight276.51 g/mol
Exact Mass276.28
IUPAC Name(6E,10Z,14E)-icosa-6,10,14-triene
SMILESCCCCC/C=C/CC/C=C\CC/C=C/CCCCC
InChIInChI=1S/C20H36/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h11-14,19-20H,3-10,15-18H2,1-2H3/b13-11+,14-12+,20-19-
InChIKeyWTNISNHDOSVBEL-LICCHUDCSA-N
XLogP7.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds14
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.51
LogP ≤ 57.38
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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Related Compounds

heptadeca-5,9-diene
CID 123203573
(5E,9E)-nonacosa-5,9-diene
CID 56936191
(Z)-tricos-11-ene
CID 5356790
(E)-hexadec-6-ene
CID 5352260
(Z)-docos-9-ene
CID 11690102
(E)-hexacos-10-ene
CID 22172169
(E)-nonacos-10-ene
CID 14367300
(24Z)-hexatriaconta-9,24-diene
CID 173127472
tetratriacont-8-ene
CID 123670593
(E)-icos-10-ene
CID 10468895
heptatriacont-13-ene
CID 71378710
(E)-docos-6-ene
CID 22172020

Frequently Asked Questions

What is the IUPAC name of (6E,10Z,14E)-icosa-6,10,14-triene?
The IUPAC name of (6E,10Z,14E)-icosa-6,10,14-triene (CID 53230462) is (6E,10Z,14E)-icosa-6,10,14-triene.
What is the SMILES notation for (6E,10Z,14E)-icosa-6,10,14-triene?
The canonical SMILES for (6E,10Z,14E)-icosa-6,10,14-triene is CCCCC/C=C/CC/C=C\CC/C=C/CCCCC.
What is the InChIKey of (6E,10Z,14E)-icosa-6,10,14-triene?
The InChIKey is WTNISNHDOSVBEL-LICCHUDCSA-N. The full InChI is InChI=1S/C20H36/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h11-14,19-20H,3-10,15-18H2,1-2H3/b13-11+,14-12+,20-19-.
What are the key properties of (6E,10Z,14E)-icosa-6,10,14-triene?
(6E,10Z,14E)-icosa-6,10,14-triene has a molecular weight of 276.51 g/mol, XLogP of 7.38, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6E,10Z,14E)-icosa-6,10,14-triene is sourced from PubChem (CID 53230462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).