(2E,4E,6Z)-3,4-dimethylocta-2,4,6-triene

C10H16 — CID 91748402

IUPAC(2E,4E,6Z)-3,4-dimethylocta-2,4,6-triene
SMILESC/C=C\C=C(C)\C(C)=C\C
InChIInChI=1S/C10H16/c1-5-7-8-10(4)9(3)6-2/h5-8H,1-4H3/b7-5-,9-6+,10-8+
InChIKeyWGAUMWNVHAMGJF-BZDCPZFQSA-N
MW136.24 g/mol
LogP3.47
Rot. Bonds2

About (2E,4E,6Z)-3,4-dimethylocta-2,4,6-triene

(2E,4E,6Z)-3,4-dimethylocta-2,4,6-triene (PubChem CID 91748402) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is (2E,4E,6Z)-3,4-dimethylocta-2,4,6-triene.

Molecular Properties

Compound Name(2E,4E,6Z)-3,4-dimethylocta-2,4,6-triene
PubChem CID91748402
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name(2E,4E,6Z)-3,4-dimethylocta-2,4,6-triene
SMILESC/C=C\C=C(C)\C(C)=C\C
InChIInChI=1S/C10H16/c1-5-7-8-10(4)9(3)6-2/h5-8H,1-4H3/b7-5-,9-6+,10-8+
InChIKeyWGAUMWNVHAMGJF-BZDCPZFQSA-N
XLogP3.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 53.47
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

(4E,6E,8E,10E,12E,14E,16Z)-2,5,6,9,10,13,14-heptamethyloctadeca-2,4,6,8,10,12,14,16-octaene;sulfane
CID 159683667
(2E,4E,6Z)-N,3,4-trimethylocta-2,4,6-trien-1-imine
CID 166983281
(2E,4E,6Z,8E)-3,6-dimethyldeca-2,4,6,8-tetraen-4-ol
CID 143088479
4-ethyl-5-methylnona-2,3,5,7-tetraene
CID 173264693
7-bromo-5-methyl-6-methylidenenona-2,4,7-triene
CID 123192453
(4E,6Z)-3-methyl-4-methylsulfonylocta-2,4,6-triene
CID 173385385
2-bromo-6-methyl-5-methylidenedeca-1,3,6,8-tetraene
CID 91077238
ethane;(2Z,4E)-hexa-2,4-diene-2-thiol
CID 143240532
N'-[(2Z,4Z)-hexa-2,4-dien-2-yl]methanimidamide
CID 88952109
(3Z,5Z,7Z)-5-[(Z)-but-2-en-2-yl]-3-methylnona-1,3,5,7-tetraene
CID 143450830
(2Z,4E,6E)-4-bromoocta-2,4,6-triene
CID 89381350
(2Z,4E)-N-methylhexa-2,4-dien-2-amine
CID 142249043

Frequently Asked Questions

What is the IUPAC name of (2E,4E,6Z)-3,4-dimethylocta-2,4,6-triene?
The IUPAC name of (2E,4E,6Z)-3,4-dimethylocta-2,4,6-triene (CID 91748402) is (2E,4E,6Z)-3,4-dimethylocta-2,4,6-triene.
What is the SMILES notation for (2E,4E,6Z)-3,4-dimethylocta-2,4,6-triene?
The canonical SMILES for (2E,4E,6Z)-3,4-dimethylocta-2,4,6-triene is C/C=C\C=C(C)\C(C)=C\C.
What is the InChIKey of (2E,4E,6Z)-3,4-dimethylocta-2,4,6-triene?
The InChIKey is WGAUMWNVHAMGJF-BZDCPZFQSA-N. The full InChI is InChI=1S/C10H16/c1-5-7-8-10(4)9(3)6-2/h5-8H,1-4H3/b7-5-,9-6+,10-8+.
What are the key properties of (2E,4E,6Z)-3,4-dimethylocta-2,4,6-triene?
(2E,4E,6Z)-3,4-dimethylocta-2,4,6-triene has a molecular weight of 136.24 g/mol, XLogP of 3.47, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4E,6Z)-3,4-dimethylocta-2,4,6-triene is sourced from PubChem (CID 91748402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).