1-ethoxy-5-[(2-methylpropan-2-yl)oxy]pentane

C11H24O2 — CID 88911131

IUPAC1-ethoxy-5-[(2-methylpropan-2-yl)oxy]pentane
SMILESCCOCCCCCOC(C)(C)C
InChIInChI=1S/C11H24O2/c1-5-12-9-7-6-8-10-13-11(2,3)4/h5-10H2,1-4H3
InChIKeyZJRKJDKHQMCEHT-UHFFFAOYSA-N
MW188.31 g/mol
LogP3.01
Rot. Bonds7

About 1-ethoxy-5-[(2-methylpropan-2-yl)oxy]pentane

1-ethoxy-5-[(2-methylpropan-2-yl)oxy]pentane (PubChem CID 88911131) has the molecular formula C11H24O2 and a molecular weight of 188.31 g/mol. Its IUPAC name is 1-ethoxy-5-[(2-methylpropan-2-yl)oxy]pentane.

Molecular Properties

Compound Name1-ethoxy-5-[(2-methylpropan-2-yl)oxy]pentane
PubChem CID88911131
Molecular FormulaC11H24O2
Molecular Weight188.31 g/mol
Exact Mass188.18
IUPAC Name1-ethoxy-5-[(2-methylpropan-2-yl)oxy]pentane
SMILESCCOCCCCCOC(C)(C)C
InChIInChI=1S/C11H24O2/c1-5-12-9-7-6-8-10-13-11(2,3)4/h5-10H2,1-4H3
InChIKeyZJRKJDKHQMCEHT-UHFFFAOYSA-N
XLogP3.01
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 53.01
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-[4-(2,2-dimethylpropoxy)butoxy]-5-[(2-methylpropan-2-yl)oxy]pentane
CID 131972636
6,6-dimethyl-1-[5-[(2-methylpropan-2-yl)oxy]pentoxy]heptane
CID 159349044
1-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]hexane
CID 164583744
lithium;hydride;1-[(2-methylpropan-2-yl)oxy]octane
CID 174475120
1-ethoxy-10,10-dimethylundecane
CID 150524219
2,2-dimethyl-1-[4-[(2-methylpropan-2-yl)oxy]butoxy]propane
CID 134553500
1-ethoxy-6,6-dimethylheptane
CID 58021102
2-[2-[2-[2-[2-[13-[(2-methylpropan-2-yl)oxy]tridecoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 139595009
2-[2-[2-[2-[2-[2-[2-[13-[(2-methylpropan-2-yl)oxy]tridecoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 139596591
2-[2-[2-[2-[2-[2-[2-[2-[14-[(2-methylpropan-2-yl)oxy]tetradecoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 139596860
1-[(2-methylpropan-2-yl)oxy]-8-(2-methylpropoxy)octane
CID 173256840
1-[4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]butoxy]-4-propoxybutane
CID 134553508

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-5-[(2-methylpropan-2-yl)oxy]pentane?
The IUPAC name of 1-ethoxy-5-[(2-methylpropan-2-yl)oxy]pentane (CID 88911131) is 1-ethoxy-5-[(2-methylpropan-2-yl)oxy]pentane.
What is the SMILES notation for 1-ethoxy-5-[(2-methylpropan-2-yl)oxy]pentane?
The canonical SMILES for 1-ethoxy-5-[(2-methylpropan-2-yl)oxy]pentane is CCOCCCCCOC(C)(C)C.
What is the InChIKey of 1-ethoxy-5-[(2-methylpropan-2-yl)oxy]pentane?
The InChIKey is ZJRKJDKHQMCEHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O2/c1-5-12-9-7-6-8-10-13-11(2,3)4/h5-10H2,1-4H3.
What are the key properties of 1-ethoxy-5-[(2-methylpropan-2-yl)oxy]pentane?
1-ethoxy-5-[(2-methylpropan-2-yl)oxy]pentane has a molecular weight of 188.31 g/mol, XLogP of 3.01, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-5-[(2-methylpropan-2-yl)oxy]pentane is sourced from PubChem (CID 88911131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).