(6E,10E)-10-ethyl-2,6-dimethyldodeca-2,6,10-triene

C16H28 — CID 169000868

IUPAC(6E,10E)-10-ethyl-2,6-dimethyldodeca-2,6,10-triene
SMILESC/C=C(\CC)CC/C=C(\C)CCC=C(C)C
InChIInChI=1S/C16H28/c1-6-16(7-2)13-9-12-15(5)11-8-10-14(3)4/h6,10,12H,7-9,11,13H2,1-5H3/b15-12+,16-6+
InChIKeyLFOXLXVQMFLBEQ-NEKUXHKKSA-N
MW220.40 g/mol
LogP5.82
Rot. Bonds7

About (6E,10E)-10-ethyl-2,6-dimethyldodeca-2,6,10-triene

(6E,10E)-10-ethyl-2,6-dimethyldodeca-2,6,10-triene (PubChem CID 169000868) has the molecular formula C16H28 and a molecular weight of 220.40 g/mol. Its IUPAC name is (6E,10E)-10-ethyl-2,6-dimethyldodeca-2,6,10-triene.

Molecular Properties

Compound Name(6E,10E)-10-ethyl-2,6-dimethyldodeca-2,6,10-triene
PubChem CID169000868
Molecular FormulaC16H28
Molecular Weight220.40 g/mol
Exact Mass220.22
IUPAC Name(6E,10E)-10-ethyl-2,6-dimethyldodeca-2,6,10-triene
SMILESC/C=C(\CC)CC/C=C(\C)CCC=C(C)C
InChIInChI=1S/C16H28/c1-6-16(7-2)13-9-12-15(5)11-8-10-14(3)4/h6,10,12H,7-9,11,13H2,1-5H3/b15-12+,16-6+
InChIKeyLFOXLXVQMFLBEQ-NEKUXHKKSA-N
XLogP5.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500220.40
LogP ≤ 55.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(9Z)-9-ethyl-5-methylundeca-1,5,9-triene
CID 59685224
4-ethyl-8,12-dimethyltrideca-3,7,11-trien-1-ol
CID 156748576
(6E,10E,14E,18E)-2,6,11,15,19-pentamethylhenicosa-2,6,10,14,18-pentaene
CID 91751137
(6Z,10Z,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 24871318
(14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 131954652
(10E)-2,6,11,15-tetramethylhexadeca-2,6,10,14-tetraene
CID 173158415
2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 173324782
(3E,7E,11E)-3,7,11-trimethyltetradeca-3,7,11-triene;(6E,10E)-2,6,10-trimethyltrideca-2,6,10-triene
CID 160792784
ethane;(6E,10Z)-2,6,10-trimethyldodeca-2,6,10-triene
CID 143275958
(5E,9E)-2,6,10,14-tetramethylpentadeca-1,5,9,13-tetraene
CID 11758910
(6E,10E,15E)-2,6,10,16,20-pentamethylhenicosa-2,6,10,15,19-pentaene
CID 58662859
3,7,11-trimethyltrideca-2,6,10-triene
CID 54049885

Frequently Asked Questions

What is the IUPAC name of (6E,10E)-10-ethyl-2,6-dimethyldodeca-2,6,10-triene?
The IUPAC name of (6E,10E)-10-ethyl-2,6-dimethyldodeca-2,6,10-triene (CID 169000868) is (6E,10E)-10-ethyl-2,6-dimethyldodeca-2,6,10-triene.
What is the SMILES notation for (6E,10E)-10-ethyl-2,6-dimethyldodeca-2,6,10-triene?
The canonical SMILES for (6E,10E)-10-ethyl-2,6-dimethyldodeca-2,6,10-triene is C/C=C(\CC)CC/C=C(\C)CCC=C(C)C.
What is the InChIKey of (6E,10E)-10-ethyl-2,6-dimethyldodeca-2,6,10-triene?
The InChIKey is LFOXLXVQMFLBEQ-NEKUXHKKSA-N. The full InChI is InChI=1S/C16H28/c1-6-16(7-2)13-9-12-15(5)11-8-10-14(3)4/h6,10,12H,7-9,11,13H2,1-5H3/b15-12+,16-6+.
What are the key properties of (6E,10E)-10-ethyl-2,6-dimethyldodeca-2,6,10-triene?
(6E,10E)-10-ethyl-2,6-dimethyldodeca-2,6,10-triene has a molecular weight of 220.40 g/mol, XLogP of 5.82, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6E,10E)-10-ethyl-2,6-dimethyldodeca-2,6,10-triene is sourced from PubChem (CID 169000868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).