(6E,8E)-6,9-dimethyltetradeca-6,8-diene

C16H30 — CID 16741365

IUPAC(6E,8E)-6,9-dimethyltetradeca-6,8-diene
SMILESCCCCC/C(C)=C/C=C(\C)CCCCC
InChIInChI=1S/C16H30/c1-5-7-9-11-15(3)13-14-16(4)12-10-8-6-2/h13-14H,5-12H2,1-4H3/b15-13+,16-14+
InChIKeyZOPHQQHPFZCTBT-WXUKJITCSA-N
MW222.42 g/mol
LogP6.04
Rot. Bonds9

About (6E,8E)-6,9-dimethyltetradeca-6,8-diene

(6E,8E)-6,9-dimethyltetradeca-6,8-diene (PubChem CID 16741365) has the molecular formula C16H30 and a molecular weight of 222.42 g/mol. Its IUPAC name is (6E,8E)-6,9-dimethyltetradeca-6,8-diene.

Molecular Properties

Compound Name(6E,8E)-6,9-dimethyltetradeca-6,8-diene
PubChem CID16741365
Molecular FormulaC16H30
Molecular Weight222.42 g/mol
Exact Mass222.23
IUPAC Name(6E,8E)-6,9-dimethyltetradeca-6,8-diene
SMILESCCCCC/C(C)=C/C=C(\C)CCCCC
InChIInChI=1S/C16H30/c1-5-7-9-11-15(3)13-14-16(4)12-10-8-6-2/h13-14H,5-12H2,1-4H3/b15-13+,16-14+
InChIKeyZOPHQQHPFZCTBT-WXUKJITCSA-N
XLogP6.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500222.42
LogP ≤ 56.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

3-methyloct-2-enal
CID 54333143
4-methylnona-1,3-diene
CID 71327710
(2E,4E)-5-methyldeca-2,4-diene
CID 14899750
(2E,4E)-5-methyldodeca-2,4-diene
CID 143978306
(E)-3-methylnonadec-2-ene
CID 23160392
2-methylhept-1-en-1-ol
CID 141483452
3-methyldec-2-ene
CID 550799
(E)-3-methyltridec-2-ene
CID 22000795
4-methylheptadec-3-ene
CID 59169426
(E)-10-methylnonadec-9-ene
CID 5364653
6-methyldocos-6-ene
CID 629460
(E)-9-methylnonadec-9-ene
CID 14783585

Frequently Asked Questions

What is the IUPAC name of (6E,8E)-6,9-dimethyltetradeca-6,8-diene?
The IUPAC name of (6E,8E)-6,9-dimethyltetradeca-6,8-diene (CID 16741365) is (6E,8E)-6,9-dimethyltetradeca-6,8-diene.
What is the SMILES notation for (6E,8E)-6,9-dimethyltetradeca-6,8-diene?
The canonical SMILES for (6E,8E)-6,9-dimethyltetradeca-6,8-diene is CCCCC/C(C)=C/C=C(\C)CCCCC.
What is the InChIKey of (6E,8E)-6,9-dimethyltetradeca-6,8-diene?
The InChIKey is ZOPHQQHPFZCTBT-WXUKJITCSA-N. The full InChI is InChI=1S/C16H30/c1-5-7-9-11-15(3)13-14-16(4)12-10-8-6-2/h13-14H,5-12H2,1-4H3/b15-13+,16-14+.
What are the key properties of (6E,8E)-6,9-dimethyltetradeca-6,8-diene?
(6E,8E)-6,9-dimethyltetradeca-6,8-diene has a molecular weight of 222.42 g/mol, XLogP of 6.04, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6E,8E)-6,9-dimethyltetradeca-6,8-diene is sourced from PubChem (CID 16741365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).