2-methyldeca-2,4,6,8-tetraene

C11H16 — CID 123313204

IUPAC2-methyldeca-2,4,6,8-tetraene
SMILESCC=CC=CC=CC=C(C)C
InChIInChI=1S/C11H16/c1-4-5-6-7-8-9-10-11(2)3/h4-10H,1-3H3
InChIKeyDRUPNVWGYMKJFH-UHFFFAOYSA-N
MW148.25 g/mol
LogP3.64
Rot. Bonds3

About 2-methyldeca-2,4,6,8-tetraene

2-methyldeca-2,4,6,8-tetraene (PubChem CID 123313204) has the molecular formula C11H16 and a molecular weight of 148.25 g/mol. Its IUPAC name is 2-methyldeca-2,4,6,8-tetraene.

Molecular Properties

Compound Name2-methyldeca-2,4,6,8-tetraene
PubChem CID123313204
Molecular FormulaC11H16
Molecular Weight148.25 g/mol
Exact Mass148.13
IUPAC Name2-methyldeca-2,4,6,8-tetraene
SMILESCC=CC=CC=CC=C(C)C
InChIInChI=1S/C11H16/c1-4-5-6-7-8-9-10-11(2)3/h4-10H,1-3H3
InChIKeyDRUPNVWGYMKJFH-UHFFFAOYSA-N
XLogP3.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.25
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methyldeca-2,4,6,8-tetraene?
The IUPAC name of 2-methyldeca-2,4,6,8-tetraene (CID 123313204) is 2-methyldeca-2,4,6,8-tetraene.
What is the SMILES notation for 2-methyldeca-2,4,6,8-tetraene?
The canonical SMILES for 2-methyldeca-2,4,6,8-tetraene is CC=CC=CC=CC=C(C)C.
What is the InChIKey of 2-methyldeca-2,4,6,8-tetraene?
The InChIKey is DRUPNVWGYMKJFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16/c1-4-5-6-7-8-9-10-11(2)3/h4-10H,1-3H3.
What are the key properties of 2-methyldeca-2,4,6,8-tetraene?
2-methyldeca-2,4,6,8-tetraene has a molecular weight of 148.25 g/mol, XLogP of 3.64, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyldeca-2,4,6,8-tetraene is sourced from PubChem (CID 123313204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).