2-[2-(4-methylpentan-2-yloxy)ethoxy]ethanol

C10H22O3 — CID 18920609

IUPAC2-[2-(4-methylpentan-2-yloxy)ethoxy]ethanol
SMILESCC(C)CC(C)OCCOCCO
InChIInChI=1S/C10H22O3/c1-9(2)8-10(3)13-7-6-12-5-4-11/h9-11H,4-8H2,1-3H3
InChIKeyMOAYVURMDUYGTD-UHFFFAOYSA-N
MW190.28 g/mol
LogP1.45
Rot. Bonds8

About 2-[2-(4-methylpentan-2-yloxy)ethoxy]ethanol

2-[2-(4-methylpentan-2-yloxy)ethoxy]ethanol (PubChem CID 18920609) has the molecular formula C10H22O3 and a molecular weight of 190.28 g/mol. Its IUPAC name is 2-[2-(4-methylpentan-2-yloxy)ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(4-methylpentan-2-yloxy)ethoxy]ethanol
PubChem CID18920609
Molecular FormulaC10H22O3
Molecular Weight190.28 g/mol
Exact Mass190.16
IUPAC Name2-[2-(4-methylpentan-2-yloxy)ethoxy]ethanol
SMILESCC(C)CC(C)OCCOCCO
InChIInChI=1S/C10H22O3/c1-9(2)8-10(3)13-7-6-12-5-4-11/h9-11H,4-8H2,1-3H3
InChIKeyMOAYVURMDUYGTD-UHFFFAOYSA-N
XLogP1.45
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.28
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-methylpentan-2-yloxy)ethoxy]ethanol?
The IUPAC name of 2-[2-(4-methylpentan-2-yloxy)ethoxy]ethanol (CID 18920609) is 2-[2-(4-methylpentan-2-yloxy)ethoxy]ethanol.
What is the SMILES notation for 2-[2-(4-methylpentan-2-yloxy)ethoxy]ethanol?
The canonical SMILES for 2-[2-(4-methylpentan-2-yloxy)ethoxy]ethanol is CC(C)CC(C)OCCOCCO.
What is the InChIKey of 2-[2-(4-methylpentan-2-yloxy)ethoxy]ethanol?
The InChIKey is MOAYVURMDUYGTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O3/c1-9(2)8-10(3)13-7-6-12-5-4-11/h9-11H,4-8H2,1-3H3.
What are the key properties of 2-[2-(4-methylpentan-2-yloxy)ethoxy]ethanol?
2-[2-(4-methylpentan-2-yloxy)ethoxy]ethanol has a molecular weight of 190.28 g/mol, XLogP of 1.45, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-methylpentan-2-yloxy)ethoxy]ethanol is sourced from PubChem (CID 18920609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).