2,3,4,5-tetramethylhepta-2,4-diene

C11H20 — CID 73461532

IUPAC2,3,4,5-tetramethylhepta-2,4-diene
SMILESCCC(C)=C(C)C(C)=C(C)C
InChIInChI=1S/C11H20/c1-7-9(4)11(6)10(5)8(2)3/h7H2,1-6H3
InChIKeyPFDDAWNNKVAJON-UHFFFAOYSA-N
MW152.28 g/mol
LogP4.09
Rot. Bonds2

About 2,3,4,5-tetramethylhepta-2,4-diene

2,3,4,5-tetramethylhepta-2,4-diene (PubChem CID 73461532) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is 2,3,4,5-tetramethylhepta-2,4-diene.

Molecular Properties

Compound Name2,3,4,5-tetramethylhepta-2,4-diene
PubChem CID73461532
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name2,3,4,5-tetramethylhepta-2,4-diene
SMILESCCC(C)=C(C)C(C)=C(C)C
InChIInChI=1S/C11H20/c1-7-9(4)11(6)10(5)8(2)3/h7H2,1-6H3
InChIKeyPFDDAWNNKVAJON-UHFFFAOYSA-N
XLogP4.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 2,3,4,5-tetramethylhepta-2,4-diene 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 2,3,4,5-tetramethylhepta-2,4-diene?
The IUPAC name of 2,3,4,5-tetramethylhepta-2,4-diene (CID 73461532) is 2,3,4,5-tetramethylhepta-2,4-diene.
What is the SMILES notation for 2,3,4,5-tetramethylhepta-2,4-diene?
The canonical SMILES for 2,3,4,5-tetramethylhepta-2,4-diene is CCC(C)=C(C)C(C)=C(C)C.
What is the InChIKey of 2,3,4,5-tetramethylhepta-2,4-diene?
The InChIKey is PFDDAWNNKVAJON-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-7-9(4)11(6)10(5)8(2)3/h7H2,1-6H3.
What are the key properties of 2,3,4,5-tetramethylhepta-2,4-diene?
2,3,4,5-tetramethylhepta-2,4-diene has a molecular weight of 152.28 g/mol, XLogP of 4.09, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5-tetramethylhepta-2,4-diene is sourced from PubChem (CID 73461532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).