2-ethyl-3-(2-methoxyethyl)oxirane

C7H14O2 — CID 10313148

IUPAC2-ethyl-3-(2-methoxyethyl)oxirane
SMILESCCC1OC1CCOC
InChIInChI=1S/C7H14O2/c1-3-6-7(9-6)4-5-8-2/h6-7H,3-5H2,1-2H3
InChIKeyYZODMCAOFUWSDJ-UHFFFAOYSA-N
MW130.19 g/mol
LogP1.20
Rot. Bonds4

About 2-ethyl-3-(2-methoxyethyl)oxirane

2-ethyl-3-(2-methoxyethyl)oxirane (PubChem CID 10313148) has the molecular formula C7H14O2 and a molecular weight of 130.19 g/mol. Its IUPAC name is 2-ethyl-3-(2-methoxyethyl)oxirane.

Molecular Properties

Compound Name2-ethyl-3-(2-methoxyethyl)oxirane
PubChem CID10313148
Molecular FormulaC7H14O2
Molecular Weight130.19 g/mol
Exact Mass130.10
IUPAC Name2-ethyl-3-(2-methoxyethyl)oxirane
SMILESCCC1OC1CCOC
InChIInChI=1S/C7H14O2/c1-3-6-7(9-6)4-5-8-2/h6-7H,3-5H2,1-2H3
InChIKeyYZODMCAOFUWSDJ-UHFFFAOYSA-N
XLogP1.20
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3-(2-methoxyethyl)oxirane?
The IUPAC name of 2-ethyl-3-(2-methoxyethyl)oxirane (CID 10313148) is 2-ethyl-3-(2-methoxyethyl)oxirane.
What is the SMILES notation for 2-ethyl-3-(2-methoxyethyl)oxirane?
The canonical SMILES for 2-ethyl-3-(2-methoxyethyl)oxirane is CCC1OC1CCOC.
What is the InChIKey of 2-ethyl-3-(2-methoxyethyl)oxirane?
The InChIKey is YZODMCAOFUWSDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O2/c1-3-6-7(9-6)4-5-8-2/h6-7H,3-5H2,1-2H3.
What are the key properties of 2-ethyl-3-(2-methoxyethyl)oxirane?
2-ethyl-3-(2-methoxyethyl)oxirane has a molecular weight of 130.19 g/mol, XLogP of 1.20, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3-(2-methoxyethyl)oxirane is sourced from PubChem (CID 10313148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).