2,6-dimethyl-4-methylideneoctane

C11H22 — CID 12567282

IUPAC2,6-dimethyl-4-methylideneoctane
SMILESC=C(CC(C)C)CC(C)CC
InChIInChI=1S/C11H22/c1-6-10(4)8-11(5)7-9(2)3/h9-10H,5-8H2,1-4H3
InChIKeyFCBQFJZCLRLYQT-UHFFFAOYSA-N
MW154.30 g/mol
LogP4.02
Rot. Bonds5

About 2,6-dimethyl-4-methylideneoctane

2,6-dimethyl-4-methylideneoctane (PubChem CID 12567282) has the molecular formula C11H22 and a molecular weight of 154.30 g/mol. Its IUPAC name is 2,6-dimethyl-4-methylideneoctane.

Molecular Properties

Compound Name2,6-dimethyl-4-methylideneoctane
PubChem CID12567282
Molecular FormulaC11H22
Molecular Weight154.30 g/mol
Exact Mass154.17
IUPAC Name2,6-dimethyl-4-methylideneoctane
SMILESC=C(CC(C)C)CC(C)CC
InChIInChI=1S/C11H22/c1-6-10(4)8-11(5)7-9(2)3/h9-10H,5-8H2,1-4H3
InChIKeyFCBQFJZCLRLYQT-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

3,7-dimethyl-5-methylideneoctanal
CID 164909395
2-chloro-4-methylhex-1-ene
CID 15153636
3,6-dimethyl-4-methylideneoctane
CID 91141716
4-methyl-2-methylidenepentan-1-amine
CID 55284045
2-fluoro-5-methyl-3-methylideneheptane
CID 130181565
N,4-dimethyl-N-(2-methylbutyl)pent-1-en-2-amine
CID 90787138
7-iodo-2-methyl-4-methylidenenonane
CID 118056979
2,4-dimethylpent-1-ene;ethane
CID 143336990
(5S)-5-methyl-3-methylidenehept-1-yne
CID 15744328
6-methyl-4-methylidene-2-propylheptanenitrile
CID 174255423
3,6,11-trimethyl-9-methylidenedodec-4-ene
CID 123241851
4-methyl-2-methylidenehexanamide
CID 87496757

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-methylideneoctane?
The IUPAC name of 2,6-dimethyl-4-methylideneoctane (CID 12567282) is 2,6-dimethyl-4-methylideneoctane.
What is the SMILES notation for 2,6-dimethyl-4-methylideneoctane?
The canonical SMILES for 2,6-dimethyl-4-methylideneoctane is C=C(CC(C)C)CC(C)CC.
What is the InChIKey of 2,6-dimethyl-4-methylideneoctane?
The InChIKey is FCBQFJZCLRLYQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22/c1-6-10(4)8-11(5)7-9(2)3/h9-10H,5-8H2,1-4H3.
What are the key properties of 2,6-dimethyl-4-methylideneoctane?
2,6-dimethyl-4-methylideneoctane 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 2,6-dimethyl-4-methylideneoctane is sourced from PubChem (CID 12567282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).