6,15-dimethylhexadeca-1,6,9,14-tetraene

C18H30 — CID 173346096

IUPAC6,15-dimethylhexadeca-1,6,9,14-tetraene
SMILESC=CCCCC(C)=CCC=CCCCC=C(C)C
InChIInChI=1S/C18H30/c1-5-6-11-15-18(4)16-13-10-8-7-9-12-14-17(2)3/h5,8,10,14,16H,1,6-7,9,11-13,15H2,2-4H3
InChIKeyOIOLGSSLNNQORY-UHFFFAOYSA-N
MW246.44 g/mol
LogP6.37
Rot. Bonds10

About 6,15-dimethylhexadeca-1,6,9,14-tetraene

6,15-dimethylhexadeca-1,6,9,14-tetraene (PubChem CID 173346096) has the molecular formula C18H30 and a molecular weight of 246.44 g/mol. Its IUPAC name is 6,15-dimethylhexadeca-1,6,9,14-tetraene.

Molecular Properties

Compound Name6,15-dimethylhexadeca-1,6,9,14-tetraene
PubChem CID173346096
Molecular FormulaC18H30
Molecular Weight246.44 g/mol
Exact Mass246.23
IUPAC Name6,15-dimethylhexadeca-1,6,9,14-tetraene
SMILESC=CCCCC(C)=CCC=CCCCC=C(C)C
InChIInChI=1S/C18H30/c1-5-6-11-15-18(4)16-13-10-8-7-9-12-14-17(2)3/h5,8,10,14,16H,1,6-7,9,11-13,15H2,2-4H3
InChIKeyOIOLGSSLNNQORY-UHFFFAOYSA-N
XLogP6.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500246.44
LogP ≤ 56.37
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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Frequently Asked Questions

What is the IUPAC name of 6,15-dimethylhexadeca-1,6,9,14-tetraene?
The IUPAC name of 6,15-dimethylhexadeca-1,6,9,14-tetraene (CID 173346096) is 6,15-dimethylhexadeca-1,6,9,14-tetraene.
What is the SMILES notation for 6,15-dimethylhexadeca-1,6,9,14-tetraene?
The canonical SMILES for 6,15-dimethylhexadeca-1,6,9,14-tetraene is C=CCCCC(C)=CCC=CCCCC=C(C)C.
What is the InChIKey of 6,15-dimethylhexadeca-1,6,9,14-tetraene?
The InChIKey is OIOLGSSLNNQORY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30/c1-5-6-11-15-18(4)16-13-10-8-7-9-12-14-17(2)3/h5,8,10,14,16H,1,6-7,9,11-13,15H2,2-4H3.
What are the key properties of 6,15-dimethylhexadeca-1,6,9,14-tetraene?
6,15-dimethylhexadeca-1,6,9,14-tetraene has a molecular weight of 246.44 g/mol, XLogP of 6.37, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6,15-dimethylhexadeca-1,6,9,14-tetraene is sourced from PubChem (CID 173346096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).