(3-ethyl-2H-oxet-2-yl)methanol

C6H10O2 — CID 68667719

IUPAC(3-ethyl-2H-oxet-2-yl)methanol
SMILESCCC1=COC1CO
InChIInChI=1S/C6H10O2/c1-2-5-4-8-6(5)3-7/h4,6-7H,2-3H2,1H3
InChIKeyHWRUNWWOMDGKEO-UHFFFAOYSA-N
MW114.14 g/mol
LogP0.67
Rot. Bonds2

About (3-ethyl-2H-oxet-2-yl)methanol

(3-ethyl-2H-oxet-2-yl)methanol (PubChem CID 68667719) has the molecular formula C6H10O2 and a molecular weight of 114.14 g/mol. Its IUPAC name is (3-ethyl-2H-oxet-2-yl)methanol.

Molecular Properties

Compound Name(3-ethyl-2H-oxet-2-yl)methanol
PubChem CID68667719
Molecular FormulaC6H10O2
Molecular Weight114.14 g/mol
Exact Mass114.07
IUPAC Name(3-ethyl-2H-oxet-2-yl)methanol
SMILESCCC1=COC1CO
InChIInChI=1S/C6H10O2/c1-2-5-4-8-6(5)3-7/h4,6-7H,2-3H2,1H3
InChIKeyHWRUNWWOMDGKEO-UHFFFAOYSA-N
XLogP0.67
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.14
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3-ethyl-2H-oxet-2-yl)methanol?
The IUPAC name of (3-ethyl-2H-oxet-2-yl)methanol (CID 68667719) is (3-ethyl-2H-oxet-2-yl)methanol.
What is the SMILES notation for (3-ethyl-2H-oxet-2-yl)methanol?
The canonical SMILES for (3-ethyl-2H-oxet-2-yl)methanol is CCC1=COC1CO.
What is the InChIKey of (3-ethyl-2H-oxet-2-yl)methanol?
The InChIKey is HWRUNWWOMDGKEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O2/c1-2-5-4-8-6(5)3-7/h4,6-7H,2-3H2,1H3.
What are the key properties of (3-ethyl-2H-oxet-2-yl)methanol?
(3-ethyl-2H-oxet-2-yl)methanol has a molecular weight of 114.14 g/mol, XLogP of 0.67, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethyl-2H-oxet-2-yl)methanol is sourced from PubChem (CID 68667719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).