2-(3-methyloxetan-3-yl)oxyethanol

C6H12O3 — CID 132517064

IUPAC2-(3-methyloxetan-3-yl)oxyethanol
SMILESCC1(OCCO)COC1
InChIInChI=1S/C6H12O3/c1-6(4-8-5-6)9-3-2-7/h7H,2-5H2,1H3
InChIKeyMCHLXLPXUWQDKU-UHFFFAOYSA-N
MW132.16 g/mol
LogP-0.22
Rot. Bonds3

About 2-(3-methyloxetan-3-yl)oxyethanol

2-(3-methyloxetan-3-yl)oxyethanol (PubChem CID 132517064) has the molecular formula C6H12O3 and a molecular weight of 132.16 g/mol. Its IUPAC name is 2-(3-methyloxetan-3-yl)oxyethanol.

Molecular Properties

Compound Name2-(3-methyloxetan-3-yl)oxyethanol
PubChem CID132517064
Molecular FormulaC6H12O3
Molecular Weight132.16 g/mol
Exact Mass132.08
IUPAC Name2-(3-methyloxetan-3-yl)oxyethanol
SMILESCC1(OCCO)COC1
InChIInChI=1S/C6H12O3/c1-6(4-8-5-6)9-3-2-7/h7H,2-5H2,1H3
InChIKeyMCHLXLPXUWQDKU-UHFFFAOYSA-N
XLogP-0.22
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.16
LogP ≤ 5-0.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methyloxetan-3-yl)oxyethanol?
The IUPAC name of 2-(3-methyloxetan-3-yl)oxyethanol (CID 132517064) is 2-(3-methyloxetan-3-yl)oxyethanol.
What is the SMILES notation for 2-(3-methyloxetan-3-yl)oxyethanol?
The canonical SMILES for 2-(3-methyloxetan-3-yl)oxyethanol is CC1(OCCO)COC1.
What is the InChIKey of 2-(3-methyloxetan-3-yl)oxyethanol?
The InChIKey is MCHLXLPXUWQDKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O3/c1-6(4-8-5-6)9-3-2-7/h7H,2-5H2,1H3.
What are the key properties of 2-(3-methyloxetan-3-yl)oxyethanol?
2-(3-methyloxetan-3-yl)oxyethanol has a molecular weight of 132.16 g/mol, XLogP of -0.22, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyloxetan-3-yl)oxyethanol is sourced from PubChem (CID 132517064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).