(E)-4,8-dimethylnon-3-ene

C11H22 — CID 22743489

IUPAC(E)-4,8-dimethylnon-3-ene
SMILESCC/C=C(\C)CCCC(C)C
InChIInChI=1S/C11H22/c1-5-7-11(4)9-6-8-10(2)3/h7,10H,5-6,8-9H2,1-4H3/b11-7+
InChIKeyZRHQQXNICFTOLV-YRNVUSSQSA-N
MW154.30 g/mol
LogP4.17
Rot. Bonds5

About (E)-4,8-dimethylnon-3-ene

(E)-4,8-dimethylnon-3-ene (PubChem CID 22743489) has the molecular formula C11H22 and a molecular weight of 154.30 g/mol. Its IUPAC name is (E)-4,8-dimethylnon-3-ene.

Molecular Properties

Compound Name(E)-4,8-dimethylnon-3-ene
PubChem CID22743489
Molecular FormulaC11H22
Molecular Weight154.30 g/mol
Exact Mass154.17
IUPAC Name(E)-4,8-dimethylnon-3-ene
SMILESCC/C=C(\C)CCCC(C)C
InChIInChI=1S/C11H22/c1-5-7-11(4)9-6-8-10(2)3/h7,10H,5-6,8-9H2,1-4H3/b11-7+
InChIKeyZRHQQXNICFTOLV-YRNVUSSQSA-N
XLogP4.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.30
LogP ≤ 54.17
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 (E)-4,8-dimethylnon-3-ene?
The IUPAC name of (E)-4,8-dimethylnon-3-ene (CID 22743489) is (E)-4,8-dimethylnon-3-ene.
What is the SMILES notation for (E)-4,8-dimethylnon-3-ene?
The canonical SMILES for (E)-4,8-dimethylnon-3-ene is CC/C=C(\C)CCCC(C)C.
What is the InChIKey of (E)-4,8-dimethylnon-3-ene?
The InChIKey is ZRHQQXNICFTOLV-YRNVUSSQSA-N. The full InChI is InChI=1S/C11H22/c1-5-7-11(4)9-6-8-10(2)3/h7,10H,5-6,8-9H2,1-4H3/b11-7+.
What are the key properties of (E)-4,8-dimethylnon-3-ene?
(E)-4,8-dimethylnon-3-ene has a molecular weight of 154.30 g/mol, XLogP of 4.17, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4,8-dimethylnon-3-ene is sourced from PubChem (CID 22743489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).