1-[1-[(2-methylpropan-2-yl)oxy]propan-2-yloxy]propan-2-ol

C10H22O3 — CID 11321436

IUPAC1-[1-[(2-methylpropan-2-yl)oxy]propan-2-yloxy]propan-2-ol
SMILESCC(O)COC(C)COC(C)(C)C
InChIInChI=1S/C10H22O3/c1-8(11)6-12-9(2)7-13-10(3,4)5/h8-9,11H,6-7H2,1-5H3
InChIKeyYNCSEVSDNUYVAY-UHFFFAOYSA-N
MW190.28 g/mol
LogP1.59
Rot. Bonds5

About 1-[1-[(2-methylpropan-2-yl)oxy]propan-2-yloxy]propan-2-ol

1-[1-[(2-methylpropan-2-yl)oxy]propan-2-yloxy]propan-2-ol (PubChem CID 11321436) has the molecular formula C10H22O3 and a molecular weight of 190.28 g/mol. Its IUPAC name is 1-[1-[(2-methylpropan-2-yl)oxy]propan-2-yloxy]propan-2-ol.

Molecular Properties

Compound Name1-[1-[(2-methylpropan-2-yl)oxy]propan-2-yloxy]propan-2-ol
PubChem CID11321436
Molecular FormulaC10H22O3
Molecular Weight190.28 g/mol
Exact Mass190.16
IUPAC Name1-[1-[(2-methylpropan-2-yl)oxy]propan-2-yloxy]propan-2-ol
SMILESCC(O)COC(C)COC(C)(C)C
InChIInChI=1S/C10H22O3/c1-8(11)6-12-9(2)7-13-10(3,4)5/h8-9,11H,6-7H2,1-5H3
InChIKeyYNCSEVSDNUYVAY-UHFFFAOYSA-N
XLogP1.59
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.28
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[1-[(2-methylpropan-2-yl)oxy]propan-2-yloxy]propan-2-ol?
The IUPAC name of 1-[1-[(2-methylpropan-2-yl)oxy]propan-2-yloxy]propan-2-ol (CID 11321436) is 1-[1-[(2-methylpropan-2-yl)oxy]propan-2-yloxy]propan-2-ol.
What is the SMILES notation for 1-[1-[(2-methylpropan-2-yl)oxy]propan-2-yloxy]propan-2-ol?
The canonical SMILES for 1-[1-[(2-methylpropan-2-yl)oxy]propan-2-yloxy]propan-2-ol is CC(O)COC(C)COC(C)(C)C.
What is the InChIKey of 1-[1-[(2-methylpropan-2-yl)oxy]propan-2-yloxy]propan-2-ol?
The InChIKey is YNCSEVSDNUYVAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O3/c1-8(11)6-12-9(2)7-13-10(3,4)5/h8-9,11H,6-7H2,1-5H3.
What are the key properties of 1-[1-[(2-methylpropan-2-yl)oxy]propan-2-yloxy]propan-2-ol?
1-[1-[(2-methylpropan-2-yl)oxy]propan-2-yloxy]propan-2-ol has a molecular weight of 190.28 g/mol, XLogP of 1.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(2-methylpropan-2-yl)oxy]propan-2-yloxy]propan-2-ol is sourced from PubChem (CID 11321436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).