2-[2-(2-methoxyethoxy)ethoxymethyl]oxirane;oxirane

C10H20O5 — CID 158836372

IUPAC2-[2-(2-methoxyethoxy)ethoxymethyl]oxirane;oxirane
SMILESC1CO1.COCCOCCOCC1CO1
InChIInChI=1S/C8H16O4.C2H4O/c1-9-2-3-10-4-5-11-6-8-7-12-8;1-2-3-1/h8H,2-7H2,1H3;1-2H2
InChIKeyIXROLBABCWPRIO-UHFFFAOYSA-N
MW220.26 g/mol
LogP0.08
Rot. Bonds8

About 2-[2-(2-methoxyethoxy)ethoxymethyl]oxirane;oxirane

2-[2-(2-methoxyethoxy)ethoxymethyl]oxirane;oxirane (PubChem CID 158836372) has the molecular formula C10H20O5 and a molecular weight of 220.26 g/mol. Its IUPAC name is 2-[2-(2-methoxyethoxy)ethoxymethyl]oxirane;oxirane.

Molecular Properties

Compound Name2-[2-(2-methoxyethoxy)ethoxymethyl]oxirane;oxirane
PubChem CID158836372
Molecular FormulaC10H20O5
Molecular Weight220.26 g/mol
Exact Mass220.13
IUPAC Name2-[2-(2-methoxyethoxy)ethoxymethyl]oxirane;oxirane
SMILESC1CO1.COCCOCCOCC1CO1
InChIInChI=1S/C8H16O4.C2H4O/c1-9-2-3-10-4-5-11-6-8-7-12-8;1-2-3-1/h8H,2-7H2,1H3;1-2H2
InChIKeyIXROLBABCWPRIO-UHFFFAOYSA-N
XLogP0.08
TPSA52.75 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.26
LogP ≤ 50.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methoxyethoxy)ethoxymethyl]oxirane;oxirane?
The IUPAC name of 2-[2-(2-methoxyethoxy)ethoxymethyl]oxirane;oxirane (CID 158836372) is 2-[2-(2-methoxyethoxy)ethoxymethyl]oxirane;oxirane.
What is the SMILES notation for 2-[2-(2-methoxyethoxy)ethoxymethyl]oxirane;oxirane?
The canonical SMILES for 2-[2-(2-methoxyethoxy)ethoxymethyl]oxirane;oxirane is C1CO1.COCCOCCOCC1CO1.
What is the InChIKey of 2-[2-(2-methoxyethoxy)ethoxymethyl]oxirane;oxirane?
The InChIKey is IXROLBABCWPRIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O4.C2H4O/c1-9-2-3-10-4-5-11-6-8-7-12-8;1-2-3-1/h8H,2-7H2,1H3;1-2H2.
What are the key properties of 2-[2-(2-methoxyethoxy)ethoxymethyl]oxirane;oxirane?
2-[2-(2-methoxyethoxy)ethoxymethyl]oxirane;oxirane has a molecular weight of 220.26 g/mol, XLogP of 0.08, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methoxyethoxy)ethoxymethyl]oxirane;oxirane is sourced from PubChem (CID 158836372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).