2,6,10,11-tetramethyldodeca-2,6,8-triene

C16H28 — CID 123796118

IUPAC2,6,10,11-tetramethyldodeca-2,6,8-triene
SMILESCC(C)=CCCC(C)=CC=CC(C)C(C)C
InChIInChI=1S/C16H28/c1-13(2)9-7-10-15(5)11-8-12-16(6)14(3)4/h8-9,11-12,14,16H,7,10H2,1-6H3
InChIKeyUSPYUYCUWZGLOT-UHFFFAOYSA-N
MW220.40 g/mol
LogP5.53
Rot. Bonds6

About 2,6,10,11-tetramethyldodeca-2,6,8-triene

2,6,10,11-tetramethyldodeca-2,6,8-triene (PubChem CID 123796118) has the molecular formula C16H28 and a molecular weight of 220.40 g/mol. Its IUPAC name is 2,6,10,11-tetramethyldodeca-2,6,8-triene.

Molecular Properties

Compound Name2,6,10,11-tetramethyldodeca-2,6,8-triene
PubChem CID123796118
Molecular FormulaC16H28
Molecular Weight220.40 g/mol
Exact Mass220.22
IUPAC Name2,6,10,11-tetramethyldodeca-2,6,8-triene
SMILESCC(C)=CCCC(C)=CC=CC(C)C(C)C
InChIInChI=1S/C16H28/c1-13(2)9-7-10-15(5)11-8-12-16(6)14(3)4/h8-9,11-12,14,16H,7,10H2,1-6H3
InChIKeyUSPYUYCUWZGLOT-UHFFFAOYSA-N
XLogP5.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500220.40
LogP ≤ 55.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

3,7,11-trimethyldodeca-4,6,10-trien-2-one
CID 91406530
3,7,11-trimethyldodeca-1,4,6,10-tetraen-2-ol
CID 74014383
[(1E,3E)-4,8-dimethylnona-1,3,7-trienyl]-di(propan-2-yl)phosphane
CID 50905460
2,6,10,14,18,23,27,31,35-nonamethylhexatriaconta-2,6,8,10,12,14,16,18,20,22,24,26,28,30,34-pentadecaene
CID 123174328
(6E,8E,10Z,12E,14Z,16E,18Z,20E,22Z,24E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,24,26,30-tridecaene
CID 21145326
2,8,12-trimethyltrideca-5,7,11-trien-4-one
CID 54329025
(2Z,4E)-5,9-dimethyl-2-propan-2-yldeca-2,4,8-trienenitrile
CID 11830898
3,7-dimethylocta-2,6-dienal
CID 8843
2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,24,26,28-tridecaene
CID 73229485
(4E,6E,8E,10E,12E,14E,16E,18E)-2,6,11,15,19,23-hexamethyltetracosa-2,4,6,8,10,12,14,16,18,22-decaene
CID 58079855
2,6,10,14,19,23,27,31-octamethyldotriaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,30-tetradecaene
CID 53395140
3,7,11,15-tetramethylhexadeca-2,4,6,8,10,14-hexaene
CID 123202578

Frequently Asked Questions

What is the IUPAC name of 2,6,10,11-tetramethyldodeca-2,6,8-triene?
The IUPAC name of 2,6,10,11-tetramethyldodeca-2,6,8-triene (CID 123796118) is 2,6,10,11-tetramethyldodeca-2,6,8-triene.
What is the SMILES notation for 2,6,10,11-tetramethyldodeca-2,6,8-triene?
The canonical SMILES for 2,6,10,11-tetramethyldodeca-2,6,8-triene is CC(C)=CCCC(C)=CC=CC(C)C(C)C.
What is the InChIKey of 2,6,10,11-tetramethyldodeca-2,6,8-triene?
The InChIKey is USPYUYCUWZGLOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28/c1-13(2)9-7-10-15(5)11-8-12-16(6)14(3)4/h8-9,11-12,14,16H,7,10H2,1-6H3.
What are the key properties of 2,6,10,11-tetramethyldodeca-2,6,8-triene?
2,6,10,11-tetramethyldodeca-2,6,8-triene has a molecular weight of 220.40 g/mol, XLogP of 5.53, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6,10,11-tetramethyldodeca-2,6,8-triene is sourced from PubChem (CID 123796118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).