7,9-dimethyltetradeca-1,2,3,4,5,6,9,10,11,12,13-undecaene

C16H12 — CID 59982952

IUPAC7,9-dimethyltetradeca-1,2,3,4,5,6,9,10,11,12,13-undecaene
SMILESC=C=C=C=C=C=C(C)CC(C)=C=C=C=C=C
InChIInChI=1S/C16H12/c1-5-7-9-11-13-16(4)14-15(3)12-10-8-6-2/h1-2,14H2,3-4H3
InChIKeyPOMZADMXPYZOJE-UHFFFAOYSA-N
MW204.27 g/mol
LogP3.92
Rot. Bonds2

About 7,9-dimethyltetradeca-1,2,3,4,5,6,9,10,11,12,13-undecaene

7,9-dimethyltetradeca-1,2,3,4,5,6,9,10,11,12,13-undecaene (PubChem CID 59982952) has the molecular formula C16H12 and a molecular weight of 204.27 g/mol. Its IUPAC name is 7,9-dimethyltetradeca-1,2,3,4,5,6,9,10,11,12,13-undecaene.

Molecular Properties

Compound Name7,9-dimethyltetradeca-1,2,3,4,5,6,9,10,11,12,13-undecaene
PubChem CID59982952
Molecular FormulaC16H12
Molecular Weight204.27 g/mol
Exact Mass204.09
IUPAC Name7,9-dimethyltetradeca-1,2,3,4,5,6,9,10,11,12,13-undecaene
SMILESC=C=C=C=C=C=C(C)CC(C)=C=C=C=C=C
InChIInChI=1S/C16H12/c1-5-7-9-11-13-16(4)14-15(3)12-10-8-6-2/h1-2,14H2,3-4H3
InChIKeyPOMZADMXPYZOJE-UHFFFAOYSA-N
XLogP3.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 7,9-dimethyltetradeca-1,2,3,4,5,6,9,10,11,12,13-undecaene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7,9-dimethyltetradeca-1,2,3,4,5,6,9,10,11,12,13-undecaene?
The IUPAC name of 7,9-dimethyltetradeca-1,2,3,4,5,6,9,10,11,12,13-undecaene (CID 59982952) is 7,9-dimethyltetradeca-1,2,3,4,5,6,9,10,11,12,13-undecaene.
What is the SMILES notation for 7,9-dimethyltetradeca-1,2,3,4,5,6,9,10,11,12,13-undecaene?
The canonical SMILES for 7,9-dimethyltetradeca-1,2,3,4,5,6,9,10,11,12,13-undecaene is C=C=C=C=C=C=C(C)CC(C)=C=C=C=C=C.
What is the InChIKey of 7,9-dimethyltetradeca-1,2,3,4,5,6,9,10,11,12,13-undecaene?
The InChIKey is POMZADMXPYZOJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12/c1-5-7-9-11-13-16(4)14-15(3)12-10-8-6-2/h1-2,14H2,3-4H3.
What are the key properties of 7,9-dimethyltetradeca-1,2,3,4,5,6,9,10,11,12,13-undecaene?
7,9-dimethyltetradeca-1,2,3,4,5,6,9,10,11,12,13-undecaene has a molecular weight of 204.27 g/mol, XLogP of 3.92, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7,9-dimethyltetradeca-1,2,3,4,5,6,9,10,11,12,13-undecaene is sourced from PubChem (CID 59982952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).