4,8-dimethoxy-2,10-dimethyl-6-methylideneundecane

C16H32O2 — CID 15710805

IUPAC4,8-dimethoxy-2,10-dimethyl-6-methylideneundecane
SMILESC=C(CC(CC(C)C)OC)CC(CC(C)C)OC
InChIInChI=1S/C16H32O2/c1-12(2)8-15(17-6)10-14(5)11-16(18-7)9-13(3)4/h12-13,15-16H,5,8-11H2,1-4,6-7H3
InChIKeyGHPDIXNLTKQNBC-UHFFFAOYSA-N
MW256.43 g/mol
LogP4.45
Rot. Bonds10

About 4,8-dimethoxy-2,10-dimethyl-6-methylideneundecane

4,8-dimethoxy-2,10-dimethyl-6-methylideneundecane (PubChem CID 15710805) has the molecular formula C16H32O2 and a molecular weight of 256.43 g/mol. Its IUPAC name is 4,8-dimethoxy-2,10-dimethyl-6-methylideneundecane.

Molecular Properties

Compound Name4,8-dimethoxy-2,10-dimethyl-6-methylideneundecane
PubChem CID15710805
Molecular FormulaC16H32O2
Molecular Weight256.43 g/mol
Exact Mass256.24
IUPAC Name4,8-dimethoxy-2,10-dimethyl-6-methylideneundecane
SMILESC=C(CC(CC(C)C)OC)CC(CC(C)C)OC
InChIInChI=1S/C16H32O2/c1-12(2)8-15(17-6)10-14(5)11-16(18-7)9-13(3)4/h12-13,15-16H,5,8-11H2,1-4,6-7H3
InChIKeyGHPDIXNLTKQNBC-UHFFFAOYSA-N
XLogP4.45
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 4,8-dimethoxy-2,10-dimethyl-6-methylideneundecane?
The IUPAC name of 4,8-dimethoxy-2,10-dimethyl-6-methylideneundecane (CID 15710805) is 4,8-dimethoxy-2,10-dimethyl-6-methylideneundecane.
What is the SMILES notation for 4,8-dimethoxy-2,10-dimethyl-6-methylideneundecane?
The canonical SMILES for 4,8-dimethoxy-2,10-dimethyl-6-methylideneundecane is C=C(CC(CC(C)C)OC)CC(CC(C)C)OC.
What is the InChIKey of 4,8-dimethoxy-2,10-dimethyl-6-methylideneundecane?
The InChIKey is GHPDIXNLTKQNBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O2/c1-12(2)8-15(17-6)10-14(5)11-16(18-7)9-13(3)4/h12-13,15-16H,5,8-11H2,1-4,6-7H3.
What are the key properties of 4,8-dimethoxy-2,10-dimethyl-6-methylideneundecane?
4,8-dimethoxy-2,10-dimethyl-6-methylideneundecane has a molecular weight of 256.43 g/mol, XLogP of 4.45, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,8-dimethoxy-2,10-dimethyl-6-methylideneundecane is sourced from PubChem (CID 15710805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).