(2Z,7Z)-3,7-dimethylnona-2,4,7-triene

C11H18 — CID 143472362

IUPAC(2Z,7Z)-3,7-dimethylnona-2,4,7-triene
SMILESC/C=C(/C)C=CC/C(C)=C\C
InChIInChI=1S/C11H18/c1-5-10(3)8-7-9-11(4)6-2/h5-8H,9H2,1-4H3/b8-7?,10-5-,11-6-
InChIKeyWEUHCQJJAJJJMV-QNHCYKPHSA-N
MW150.26 g/mol
LogP3.87
Rot. Bonds3

About (2Z,7Z)-3,7-dimethylnona-2,4,7-triene

(2Z,7Z)-3,7-dimethylnona-2,4,7-triene (PubChem CID 143472362) has the molecular formula C11H18 and a molecular weight of 150.26 g/mol. Its IUPAC name is (2Z,7Z)-3,7-dimethylnona-2,4,7-triene.

Molecular Properties

Compound Name(2Z,7Z)-3,7-dimethylnona-2,4,7-triene
PubChem CID143472362
Molecular FormulaC11H18
Molecular Weight150.26 g/mol
Exact Mass150.14
IUPAC Name(2Z,7Z)-3,7-dimethylnona-2,4,7-triene
SMILESC/C=C(/C)C=CC/C(C)=C\C
InChIInChI=1S/C11H18/c1-5-10(3)8-7-9-11(4)6-2/h5-8H,9H2,1-4H3/b8-7?,10-5-,11-6-
InChIKeyWEUHCQJJAJJJMV-QNHCYKPHSA-N
XLogP3.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.26
LogP ≤ 53.87
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'}

Analyze (2Z,7Z)-3,7-dimethylnona-2,4,7-triene 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 (2Z,7Z)-3,7-dimethylnona-2,4,7-triene?
The IUPAC name of (2Z,7Z)-3,7-dimethylnona-2,4,7-triene (CID 143472362) is (2Z,7Z)-3,7-dimethylnona-2,4,7-triene.
What is the SMILES notation for (2Z,7Z)-3,7-dimethylnona-2,4,7-triene?
The canonical SMILES for (2Z,7Z)-3,7-dimethylnona-2,4,7-triene is C/C=C(/C)C=CC/C(C)=C\C.
What is the InChIKey of (2Z,7Z)-3,7-dimethylnona-2,4,7-triene?
The InChIKey is WEUHCQJJAJJJMV-QNHCYKPHSA-N. The full InChI is InChI=1S/C11H18/c1-5-10(3)8-7-9-11(4)6-2/h5-8H,9H2,1-4H3/b8-7?,10-5-,11-6-.
What are the key properties of (2Z,7Z)-3,7-dimethylnona-2,4,7-triene?
(2Z,7Z)-3,7-dimethylnona-2,4,7-triene has a molecular weight of 150.26 g/mol, XLogP of 3.87, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,7Z)-3,7-dimethylnona-2,4,7-triene is sourced from PubChem (CID 143472362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).