2-[(2-methylpropan-2-yl)oxy]ethanol

C6H14O2 — CID 24232

IUPAC2-[(2-methylpropan-2-yl)oxy]ethanol
SMILESCC(C)(C)OCCO
InChIInChI=1S/C6H14O2/c1-6(2,3)8-5-4-7/h7H,4-5H2,1-3H3
InChIKeyBDLXTDLGTWNUFM-UHFFFAOYSA-N
MW118.18 g/mol
LogP0.79
Rot. Bonds2

About 2-[(2-methylpropan-2-yl)oxy]ethanol

2-[(2-methylpropan-2-yl)oxy]ethanol (PubChem CID 24232) has the molecular formula C6H14O2 and a molecular weight of 118.18 g/mol. Its IUPAC name is 2-[(2-methylpropan-2-yl)oxy]ethanol.

Molecular Properties

Compound Name2-[(2-methylpropan-2-yl)oxy]ethanol
PubChem CID24232
Molecular FormulaC6H14O2
Molecular Weight118.18 g/mol
Exact Mass118.10
IUPAC Name2-[(2-methylpropan-2-yl)oxy]ethanol
SMILESCC(C)(C)OCCO
InChIInChI=1S/C6H14O2/c1-6(2,3)8-5-4-7/h7H,4-5H2,1-3H3
InChIKeyBDLXTDLGTWNUFM-UHFFFAOYSA-N
XLogP0.79
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.18
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylpropan-2-yl)oxy]ethanol?
The IUPAC name of 2-[(2-methylpropan-2-yl)oxy]ethanol (CID 24232) is 2-[(2-methylpropan-2-yl)oxy]ethanol.
What is the SMILES notation for 2-[(2-methylpropan-2-yl)oxy]ethanol?
The canonical SMILES for 2-[(2-methylpropan-2-yl)oxy]ethanol is CC(C)(C)OCCO.
What is the InChIKey of 2-[(2-methylpropan-2-yl)oxy]ethanol?
The InChIKey is BDLXTDLGTWNUFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O2/c1-6(2,3)8-5-4-7/h7H,4-5H2,1-3H3.
What are the key properties of 2-[(2-methylpropan-2-yl)oxy]ethanol?
2-[(2-methylpropan-2-yl)oxy]ethanol has a molecular weight of 118.18 g/mol, XLogP of 0.79, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylpropan-2-yl)oxy]ethanol is sourced from PubChem (CID 24232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).