(6Z,8Z)-2,11-dimethyldodeca-2,6,8-triene

C14H24 — CID 165392440

IUPAC(6Z,8Z)-2,11-dimethyldodeca-2,6,8-triene
SMILESCC(C)=CCC/C=C\C=C/CC(C)C
InChIInChI=1S/C14H24/c1-13(2)11-9-7-5-6-8-10-12-14(3)4/h5-7,9,12-13H,8,10-11H2,1-4H3/b6-5-,9-7-
InChIKeyNWKPXSUYHYSMFH-LZWBOMALSA-N
MW192.35 g/mol
LogP4.89
Rot. Bonds6

About (6Z,8Z)-2,11-dimethyldodeca-2,6,8-triene

(6Z,8Z)-2,11-dimethyldodeca-2,6,8-triene (PubChem CID 165392440) has the molecular formula C14H24 and a molecular weight of 192.35 g/mol. Its IUPAC name is (6Z,8Z)-2,11-dimethyldodeca-2,6,8-triene.

Molecular Properties

Compound Name(6Z,8Z)-2,11-dimethyldodeca-2,6,8-triene
PubChem CID165392440
Molecular FormulaC14H24
Molecular Weight192.35 g/mol
Exact Mass192.19
IUPAC Name(6Z,8Z)-2,11-dimethyldodeca-2,6,8-triene
SMILESCC(C)=CCC/C=C\C=C/CC(C)C
InChIInChI=1S/C14H24/c1-13(2)11-9-7-5-6-8-10-12-14(3)4/h5-7,9,12-13H,8,10-11H2,1-4H3/b6-5-,9-7-
InChIKeyNWKPXSUYHYSMFH-LZWBOMALSA-N
XLogP4.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.35
LogP ≤ 54.89
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'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (6Z,8Z)-2,11-dimethyldodeca-2,6,8-triene?
The IUPAC name of (6Z,8Z)-2,11-dimethyldodeca-2,6,8-triene (CID 165392440) is (6Z,8Z)-2,11-dimethyldodeca-2,6,8-triene.
What is the SMILES notation for (6Z,8Z)-2,11-dimethyldodeca-2,6,8-triene?
The canonical SMILES for (6Z,8Z)-2,11-dimethyldodeca-2,6,8-triene is CC(C)=CCC/C=C\C=C/CC(C)C.
What is the InChIKey of (6Z,8Z)-2,11-dimethyldodeca-2,6,8-triene?
The InChIKey is NWKPXSUYHYSMFH-LZWBOMALSA-N. The full InChI is InChI=1S/C14H24/c1-13(2)11-9-7-5-6-8-10-12-14(3)4/h5-7,9,12-13H,8,10-11H2,1-4H3/b6-5-,9-7-.
What are the key properties of (6Z,8Z)-2,11-dimethyldodeca-2,6,8-triene?
(6Z,8Z)-2,11-dimethyldodeca-2,6,8-triene has a molecular weight of 192.35 g/mol, XLogP of 4.89, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z,8Z)-2,11-dimethyldodeca-2,6,8-triene is sourced from PubChem (CID 165392440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).