2,8-dimethylnon-4-ene

C11H22 — CID 54058844

IUPAC2,8-dimethylnon-4-ene
SMILESCC(C)CC=CCCC(C)C
InChIInChI=1S/C11H22/c1-10(2)8-6-5-7-9-11(3)4/h5-6,10-11H,7-9H2,1-4H3
InChIKeyPBRGUXDXCQXEMC-UHFFFAOYSA-N
MW154.30 g/mol
LogP4.02
Rot. Bonds5

About 2,8-dimethylnon-4-ene

2,8-dimethylnon-4-ene (PubChem CID 54058844) has the molecular formula C11H22 and a molecular weight of 154.30 g/mol. Its IUPAC name is 2,8-dimethylnon-4-ene.

Molecular Properties

Compound Name2,8-dimethylnon-4-ene
PubChem CID54058844
Molecular FormulaC11H22
Molecular Weight154.30 g/mol
Exact Mass154.17
IUPAC Name2,8-dimethylnon-4-ene
SMILESCC(C)CC=CCCC(C)C
InChIInChI=1S/C11H22/c1-10(2)8-6-5-7-9-11(3)4/h5-6,10-11H,7-9H2,1-4H3
InChIKeyPBRGUXDXCQXEMC-UHFFFAOYSA-N
XLogP4.02
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 ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2,13-dimethyltetradec-4-ene
CID 139930710
3,9-dimethyldeca-1,6-diene
CID 173018442
1-bromo-6-methylhept-3-ene
CID 79006953
10-methylundeca-3,7-diene
CID 91333064
(E)-2,11-dimethyldodec-5-ene
CID 168834978
3,10-dimethylundeca-2,7-dien-4-ol
CID 123787475
8-methylnona-1,5-diene
CID 54303226
2,9-dimethylundec-5-ene
CID 123952487
5-methylhex-1-en-1-amine
CID 87108942
(E)-2-methyldec-4-ene
CID 5364887
trimethyl(7-methyloct-3-enyl)azanium
CID 123575758
1,1,1-trifluoro-8-methylnon-4-ene
CID 123891498

Frequently Asked Questions

What is the IUPAC name of 2,8-dimethylnon-4-ene?
The IUPAC name of 2,8-dimethylnon-4-ene (CID 54058844) is 2,8-dimethylnon-4-ene.
What is the SMILES notation for 2,8-dimethylnon-4-ene?
The canonical SMILES for 2,8-dimethylnon-4-ene is CC(C)CC=CCCC(C)C.
What is the InChIKey of 2,8-dimethylnon-4-ene?
The InChIKey is PBRGUXDXCQXEMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22/c1-10(2)8-6-5-7-9-11(3)4/h5-6,10-11H,7-9H2,1-4H3.
What are the key properties of 2,8-dimethylnon-4-ene?
2,8-dimethylnon-4-ene has a molecular weight of 154.30 g/mol, XLogP of 4.02, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,8-dimethylnon-4-ene is sourced from PubChem (CID 54058844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).