(6E,10E,14E)-2,6,10,14,17-pentamethyloctadeca-2,6,10,14-tetraene

C23H40 — CID 140685405

IUPAC(6E,10E,14E)-2,6,10,14,17-pentamethyloctadeca-2,6,10,14-tetraene
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC(C)C
InChIInChI=1S/C23H40/c1-19(2)11-8-12-21(5)13-9-14-22(6)15-10-16-23(7)18-17-20(3)4/h11,13,15,18,20H,8-10,12,14,16-17H2,1-7H3/b21-13+,22-15+,23-18+
InChIKeyPLLMLHTXXWBUJP-UZENZRIMSA-N
MW316.57 g/mol
LogP8.18
Rot. Bonds11

About (6E,10E,14E)-2,6,10,14,17-pentamethyloctadeca-2,6,10,14-tetraene

(6E,10E,14E)-2,6,10,14,17-pentamethyloctadeca-2,6,10,14-tetraene (PubChem CID 140685405) has the molecular formula C23H40 and a molecular weight of 316.57 g/mol. Its IUPAC name is (6E,10E,14E)-2,6,10,14,17-pentamethyloctadeca-2,6,10,14-tetraene.

Molecular Properties

Compound Name(6E,10E,14E)-2,6,10,14,17-pentamethyloctadeca-2,6,10,14-tetraene
PubChem CID140685405
Molecular FormulaC23H40
Molecular Weight316.57 g/mol
Exact Mass316.31
IUPAC Name(6E,10E,14E)-2,6,10,14,17-pentamethyloctadeca-2,6,10,14-tetraene
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC(C)C
InChIInChI=1S/C23H40/c1-19(2)11-8-12-21(5)13-9-14-22(6)15-10-16-23(7)18-17-20(3)4/h11,13,15,18,20H,8-10,12,14,16-17H2,1-7H3/b21-13+,22-15+,23-18+
InChIKeyPLLMLHTXXWBUJP-UZENZRIMSA-N
XLogP8.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500316.57
LogP ≤ 58.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(10E)-2,6,11,15-tetramethylhexadeca-2,6,10,14-tetraene
CID 173158415
(6Z,10Z,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 24871318
(14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 131954652
2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 173324782
(6E,10E,14E)-2,6,10,15,18-pentamethylnonadeca-2,6,10,14-tetraene
CID 58369783
(14E,18E,22E)-2,6,10,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-12-ol
CID 88794076
(5E,9E)-N-tert-butyl-5,9,12-trimethyltrideca-5,9-dien-2-imine
CID 138650644
(6E,10E,15E)-2,6,10,16,20-pentamethylhenicosa-2,6,10,15,19-pentaene
CID 58662859
6,10,14-trimethyl-3-(3,7,11-trimethyldodeca-2,6,10-trienyl)pentadeca-5,9,13-trien-1-ol
CID 54034221
(4E,8E)-5,9,13-trimethyltetradeca-4,8,12-triene-1,2-diamine
CID 90116637
(5E,9E,13E)-6,10,14,18-tetramethylnonadeca-5,9,13,17-tetraene-1,2,3-triol
CID 121434427
(2Z,6E,10E,14E)-3,7,11,15,19-pentamethylicosa-2,6,10,14,18-pentaen-1-ol
CID 90659053

Frequently Asked Questions

What is the IUPAC name of (6E,10E,14E)-2,6,10,14,17-pentamethyloctadeca-2,6,10,14-tetraene?
The IUPAC name of (6E,10E,14E)-2,6,10,14,17-pentamethyloctadeca-2,6,10,14-tetraene (CID 140685405) is (6E,10E,14E)-2,6,10,14,17-pentamethyloctadeca-2,6,10,14-tetraene.
What is the SMILES notation for (6E,10E,14E)-2,6,10,14,17-pentamethyloctadeca-2,6,10,14-tetraene?
The canonical SMILES for (6E,10E,14E)-2,6,10,14,17-pentamethyloctadeca-2,6,10,14-tetraene is CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC(C)C.
What is the InChIKey of (6E,10E,14E)-2,6,10,14,17-pentamethyloctadeca-2,6,10,14-tetraene?
The InChIKey is PLLMLHTXXWBUJP-UZENZRIMSA-N. The full InChI is InChI=1S/C23H40/c1-19(2)11-8-12-21(5)13-9-14-22(6)15-10-16-23(7)18-17-20(3)4/h11,13,15,18,20H,8-10,12,14,16-17H2,1-7H3/b21-13+,22-15+,23-18+.
What are the key properties of (6E,10E,14E)-2,6,10,14,17-pentamethyloctadeca-2,6,10,14-tetraene?
(6E,10E,14E)-2,6,10,14,17-pentamethyloctadeca-2,6,10,14-tetraene has a molecular weight of 316.57 g/mol, XLogP of 8.18, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6E,10E,14E)-2,6,10,14,17-pentamethyloctadeca-2,6,10,14-tetraene is sourced from PubChem (CID 140685405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).