4-ethenyl-3,8-dimethyldeca-2,4,6-triene

C14H22 — CID 123413794

IUPAC4-ethenyl-3,8-dimethyldeca-2,4,6-triene
SMILESC=CC(=CC=CC(C)CC)C(C)=CC
InChIInChI=1S/C14H22/c1-6-12(4)10-9-11-14(8-3)13(5)7-2/h7-12H,3,6H2,1-2,4-5H3
InChIKeyUHFYWVKWGXZAOA-UHFFFAOYSA-N
MW190.33 g/mol
LogP4.67
Rot. Bonds5

About 4-ethenyl-3,8-dimethyldeca-2,4,6-triene

4-ethenyl-3,8-dimethyldeca-2,4,6-triene (PubChem CID 123413794) has the molecular formula C14H22 and a molecular weight of 190.33 g/mol. Its IUPAC name is 4-ethenyl-3,8-dimethyldeca-2,4,6-triene.

Molecular Properties

Compound Name4-ethenyl-3,8-dimethyldeca-2,4,6-triene
PubChem CID123413794
Molecular FormulaC14H22
Molecular Weight190.33 g/mol
Exact Mass190.17
IUPAC Name4-ethenyl-3,8-dimethyldeca-2,4,6-triene
SMILESC=CC(=CC=CC(C)CC)C(C)=CC
InChIInChI=1S/C14H22/c1-6-12(4)10-9-11-14(8-3)13(5)7-2/h7-12H,3,6H2,1-2,4-5H3
InChIKeyUHFYWVKWGXZAOA-UHFFFAOYSA-N
XLogP4.67
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.33
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(2R,4E,6E,8S)-2,4,8-trimethyldeca-4,6-dien-1-ol
CID 24773196
3-ethylidene-2,6-dimethylocta-1,4-diene
CID 90690181
(4E,6E,8S)-4,8-dimethyldeca-4,6-dienoic acid
CID 11367593
2-butan-2-yl-6-methylocta-2,4-dien-1-amine
CID 88882583
(3E,4E)-3-ethylidene-4-methylhexa-1,4-diene;N-ethylmethanimine
CID 170733911
3,6-dimethyloct-4-ene
CID 73165576
(3E,4E)-3-ethylidene-4-methylhepta-1,4-diene
CID 143688525
(3Z,5Z,7Z)-5-[(Z)-but-2-en-2-yl]-3-methylnona-1,3,5,7-tetraene
CID 143450830
tributyl-[(1E,3R,5E,7E,9S)-3,5,9-trimethylundeca-1,5,7-trienyl]stannane
CID 50993250
(2E,4Z)-6-methylnona-2,4-dien-2-ol
CID 142891903
(Z)-3,5-dimethyl-4-methylidenehex-2-ene;propane
CID 145319399
(1Z,3Z)-5-methylhepta-1,3-dien-1-amine
CID 144815707

Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-3,8-dimethyldeca-2,4,6-triene?
The IUPAC name of 4-ethenyl-3,8-dimethyldeca-2,4,6-triene (CID 123413794) is 4-ethenyl-3,8-dimethyldeca-2,4,6-triene.
What is the SMILES notation for 4-ethenyl-3,8-dimethyldeca-2,4,6-triene?
The canonical SMILES for 4-ethenyl-3,8-dimethyldeca-2,4,6-triene is C=CC(=CC=CC(C)CC)C(C)=CC.
What is the InChIKey of 4-ethenyl-3,8-dimethyldeca-2,4,6-triene?
The InChIKey is UHFYWVKWGXZAOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22/c1-6-12(4)10-9-11-14(8-3)13(5)7-2/h7-12H,3,6H2,1-2,4-5H3.
What are the key properties of 4-ethenyl-3,8-dimethyldeca-2,4,6-triene?
4-ethenyl-3,8-dimethyldeca-2,4,6-triene has a molecular weight of 190.33 g/mol, XLogP of 4.67, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-3,8-dimethyldeca-2,4,6-triene is sourced from PubChem (CID 123413794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).