3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraene

C20H34 — CID 54442023

IUPAC3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraene
SMILESC=CC(C)CCC=C(C)CCC=C(C)CCC=C(C)C
InChIInChI=1S/C20H34/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h7,11,14-15,18H,1,8-10,12-13,16H2,2-6H3
InChIKeyLRPBFUJRLRATSH-UHFFFAOYSA-N
MW274.49 g/mol
LogP7.01
Rot. Bonds10

About 3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraene

3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraene (PubChem CID 54442023) has the molecular formula C20H34 and a molecular weight of 274.49 g/mol. Its IUPAC name is 3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraene.

Molecular Properties

Compound Name3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraene
PubChem CID54442023
Molecular FormulaC20H34
Molecular Weight274.49 g/mol
Exact Mass274.27
IUPAC Name3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraene
SMILESC=CC(C)CCC=C(C)CCC=C(C)CCC=C(C)C
InChIInChI=1S/C20H34/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h7,11,14-15,18H,1,8-10,12-13,16H2,2-6H3
InChIKeyLRPBFUJRLRATSH-UHFFFAOYSA-N
XLogP7.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.49
LogP ≤ 57.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraene?
The IUPAC name of 3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraene (CID 54442023) is 3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraene.
What is the SMILES notation for 3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraene?
The canonical SMILES for 3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraene is C=CC(C)CCC=C(C)CCC=C(C)CCC=C(C)C.
What is the InChIKey of 3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraene?
The InChIKey is LRPBFUJRLRATSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H34/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h7,11,14-15,18H,1,8-10,12-13,16H2,2-6H3.
What are the key properties of 3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraene?
3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraene has a molecular weight of 274.49 g/mol, XLogP of 7.01, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraene is sourced from PubChem (CID 54442023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).