2-(2,3,4,4-tetramethylpentan-2-yloxy)ethanol

C11H24O2 — CID 142712531

IUPAC2-(2,3,4,4-tetramethylpentan-2-yloxy)ethanol
SMILESCC(C(C)(C)C)C(C)(C)OCCO
InChIInChI=1S/C11H24O2/c1-9(10(2,3)4)11(5,6)13-8-7-12/h9,12H,7-8H2,1-6H3
InChIKeyAUDMLBJOOXSSBT-UHFFFAOYSA-N
MW188.31 g/mol
LogP2.46
Rot. Bonds4

About 2-(2,3,4,4-tetramethylpentan-2-yloxy)ethanol

2-(2,3,4,4-tetramethylpentan-2-yloxy)ethanol (PubChem CID 142712531) has the molecular formula C11H24O2 and a molecular weight of 188.31 g/mol. Its IUPAC name is 2-(2,3,4,4-tetramethylpentan-2-yloxy)ethanol.

Molecular Properties

Compound Name2-(2,3,4,4-tetramethylpentan-2-yloxy)ethanol
PubChem CID142712531
Molecular FormulaC11H24O2
Molecular Weight188.31 g/mol
Exact Mass188.18
IUPAC Name2-(2,3,4,4-tetramethylpentan-2-yloxy)ethanol
SMILESCC(C(C)(C)C)C(C)(C)OCCO
InChIInChI=1S/C11H24O2/c1-9(10(2,3)4)11(5,6)13-8-7-12/h9,12H,7-8H2,1-6H3
InChIKeyAUDMLBJOOXSSBT-UHFFFAOYSA-N
XLogP2.46
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3,4,4-tetramethylpentan-2-yloxy)ethanol?
The IUPAC name of 2-(2,3,4,4-tetramethylpentan-2-yloxy)ethanol (CID 142712531) is 2-(2,3,4,4-tetramethylpentan-2-yloxy)ethanol.
What is the SMILES notation for 2-(2,3,4,4-tetramethylpentan-2-yloxy)ethanol?
The canonical SMILES for 2-(2,3,4,4-tetramethylpentan-2-yloxy)ethanol is CC(C(C)(C)C)C(C)(C)OCCO.
What is the InChIKey of 2-(2,3,4,4-tetramethylpentan-2-yloxy)ethanol?
The InChIKey is AUDMLBJOOXSSBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O2/c1-9(10(2,3)4)11(5,6)13-8-7-12/h9,12H,7-8H2,1-6H3.
What are the key properties of 2-(2,3,4,4-tetramethylpentan-2-yloxy)ethanol?
2-(2,3,4,4-tetramethylpentan-2-yloxy)ethanol has a molecular weight of 188.31 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3,4,4-tetramethylpentan-2-yloxy)ethanol is sourced from PubChem (CID 142712531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).