2-(3-methoxy-2-methylpropoxy)undecane

C16H34O2 — CID 89261106

IUPAC2-(3-methoxy-2-methylpropoxy)undecane
SMILESCCCCCCCCCC(C)OCC(C)COC
InChIInChI=1S/C16H34O2/c1-5-6-7-8-9-10-11-12-16(3)18-14-15(2)13-17-4/h15-16H,5-14H2,1-4H3
InChIKeyUEQWLIRKZDMGNV-UHFFFAOYSA-N
MW258.45 g/mol
LogP4.81
Rot. Bonds13

About 2-(3-methoxy-2-methylpropoxy)undecane

2-(3-methoxy-2-methylpropoxy)undecane (PubChem CID 89261106) has the molecular formula C16H34O2 and a molecular weight of 258.45 g/mol. Its IUPAC name is 2-(3-methoxy-2-methylpropoxy)undecane.

Molecular Properties

Compound Name2-(3-methoxy-2-methylpropoxy)undecane
PubChem CID89261106
Molecular FormulaC16H34O2
Molecular Weight258.45 g/mol
Exact Mass258.26
IUPAC Name2-(3-methoxy-2-methylpropoxy)undecane
SMILESCCCCCCCCCC(C)OCC(C)COC
InChIInChI=1S/C16H34O2/c1-5-6-7-8-9-10-11-12-16(3)18-14-15(2)13-17-4/h15-16H,5-14H2,1-4H3
InChIKeyUEQWLIRKZDMGNV-UHFFFAOYSA-N
XLogP4.81
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.45
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-methoxy-2-methyldecane
CID 13444249
1-methoxy-2,12-dimethyldocosane
CID 91752253
2-(2-methoxyethoxy)octadecane
CID 89276167
2-(methoxymethoxy)nonane
CID 13203850
1-octan-2-yloxydecane
CID 86220707
1-nonan-2-yloxyoctadecane
CID 88815684
2-decoxyundecane
CID 151498473
1-undecan-2-yloxypentadecane
CID 174433069
1-octan-2-yloxypropan-2-amine
CID 43127432
2-methyl-1-(1-octoxypropan-2-yloxy)decane
CID 23399371
1-methoxy-8,14,20-trimethylnonacosane
CID 155293079
2-ethoxytridecane
CID 54143367

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxy-2-methylpropoxy)undecane?
The IUPAC name of 2-(3-methoxy-2-methylpropoxy)undecane (CID 89261106) is 2-(3-methoxy-2-methylpropoxy)undecane.
What is the SMILES notation for 2-(3-methoxy-2-methylpropoxy)undecane?
The canonical SMILES for 2-(3-methoxy-2-methylpropoxy)undecane is CCCCCCCCCC(C)OCC(C)COC.
What is the InChIKey of 2-(3-methoxy-2-methylpropoxy)undecane?
The InChIKey is UEQWLIRKZDMGNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O2/c1-5-6-7-8-9-10-11-12-16(3)18-14-15(2)13-17-4/h15-16H,5-14H2,1-4H3.
What are the key properties of 2-(3-methoxy-2-methylpropoxy)undecane?
2-(3-methoxy-2-methylpropoxy)undecane has a molecular weight of 258.45 g/mol, XLogP of 4.81, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxy-2-methylpropoxy)undecane is sourced from PubChem (CID 89261106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).