2,4,6,8,10,12-hexamethyltrideca-1,12-diene

C19H36 — CID 91752710

IUPAC2,4,6,8,10,12-hexamethyltrideca-1,12-diene
SMILESC=C(C)CC(C)CC(C)CC(C)CC(C)CC(=C)C
InChIInChI=1S/C19H36/c1-14(2)9-16(5)11-18(7)13-19(8)12-17(6)10-15(3)4/h16-19H,1,3,9-13H2,2,4-8H3
InChIKeyAEWAVWPWBCLUIU-UHFFFAOYSA-N
MW264.50 g/mol
LogP6.63
Rot. Bonds10

About 2,4,6,8,10,12-hexamethyltrideca-1,12-diene

2,4,6,8,10,12-hexamethyltrideca-1,12-diene (PubChem CID 91752710) has the molecular formula C19H36 and a molecular weight of 264.50 g/mol. Its IUPAC name is 2,4,6,8,10,12-hexamethyltrideca-1,12-diene.

Molecular Properties

Compound Name2,4,6,8,10,12-hexamethyltrideca-1,12-diene
PubChem CID91752710
Molecular FormulaC19H36
Molecular Weight264.50 g/mol
Exact Mass264.28
IUPAC Name2,4,6,8,10,12-hexamethyltrideca-1,12-diene
SMILESC=C(C)CC(C)CC(C)CC(C)CC(C)CC(=C)C
InChIInChI=1S/C19H36/c1-14(2)9-16(5)11-18(7)13-19(8)12-17(6)10-15(3)4/h16-19H,1,3,9-13H2,2,4-8H3
InChIKeyAEWAVWPWBCLUIU-UHFFFAOYSA-N
XLogP6.63
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500264.50
LogP ≤ 56.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,4,6,8,10,12-hexamethyltrideca-1,12-diene?
The IUPAC name of 2,4,6,8,10,12-hexamethyltrideca-1,12-diene (CID 91752710) is 2,4,6,8,10,12-hexamethyltrideca-1,12-diene.
What is the SMILES notation for 2,4,6,8,10,12-hexamethyltrideca-1,12-diene?
The canonical SMILES for 2,4,6,8,10,12-hexamethyltrideca-1,12-diene is C=C(C)CC(C)CC(C)CC(C)CC(C)CC(=C)C.
What is the InChIKey of 2,4,6,8,10,12-hexamethyltrideca-1,12-diene?
The InChIKey is AEWAVWPWBCLUIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H36/c1-14(2)9-16(5)11-18(7)13-19(8)12-17(6)10-15(3)4/h16-19H,1,3,9-13H2,2,4-8H3.
What are the key properties of 2,4,6,8,10,12-hexamethyltrideca-1,12-diene?
2,4,6,8,10,12-hexamethyltrideca-1,12-diene has a molecular weight of 264.50 g/mol, XLogP of 6.63, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6,8,10,12-hexamethyltrideca-1,12-diene is sourced from PubChem (CID 91752710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).