2-[[2-(2-methoxyethoxy)-1-(oxiran-2-yl)ethoxy]methyl]oxirane

C10H18O5 — CID 87386866

IUPAC2-[[2-(2-methoxyethoxy)-1-(oxiran-2-yl)ethoxy]methyl]oxirane
SMILESCOCCOCC(OCC1CO1)C1CO1
InChIInChI=1S/C10H18O5/c1-11-2-3-12-6-9(10-7-15-10)14-5-8-4-13-8/h8-10H,2-7H2,1H3
InChIKeyPDZHNGYEALSGJS-UHFFFAOYSA-N
MW218.25 g/mol
LogP-0.17
Rot. Bonds9

About 2-[[2-(2-methoxyethoxy)-1-(oxiran-2-yl)ethoxy]methyl]oxirane

2-[[2-(2-methoxyethoxy)-1-(oxiran-2-yl)ethoxy]methyl]oxirane (PubChem CID 87386866) has the molecular formula C10H18O5 and a molecular weight of 218.25 g/mol. Its IUPAC name is 2-[[2-(2-methoxyethoxy)-1-(oxiran-2-yl)ethoxy]methyl]oxirane.

Molecular Properties

Compound Name2-[[2-(2-methoxyethoxy)-1-(oxiran-2-yl)ethoxy]methyl]oxirane
PubChem CID87386866
Molecular FormulaC10H18O5
Molecular Weight218.25 g/mol
Exact Mass218.12
IUPAC Name2-[[2-(2-methoxyethoxy)-1-(oxiran-2-yl)ethoxy]methyl]oxirane
SMILESCOCCOCC(OCC1CO1)C1CO1
InChIInChI=1S/C10H18O5/c1-11-2-3-12-6-9(10-7-15-10)14-5-8-4-13-8/h8-10H,2-7H2,1H3
InChIKeyPDZHNGYEALSGJS-UHFFFAOYSA-N
XLogP-0.17
TPSA52.75 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.25
LogP ≤ 5-0.17
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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Related Compounds

2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane
CID 90384181
2-[1-(oxiran-2-yl)butoxymethyl]oxirane
CID 151610662
[3-methoxy-1-(oxiran-2-ylmethoxy)propyl]silane
CID 173269150
4-(oxiran-2-yl)-4-(oxiran-2-ylmethoxy)butanal
CID 23171381
2-[2-(2-bromoethoxy)ethoxy]-1-(2-methoxyethoxy)propane;2-[2-[1-(2-methoxyethoxy)propan-2-yloxy]ethoxymethyl]oxirane
CID 163522489
2-[1-(2-propoxyethoxy)propan-2-yloxymethyl]oxirane
CID 134464354
2-[[1-ethoxy-2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]methyl]oxirane
CID 150746086
2-[[3-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-2,2-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxymethyl]propoxy]methyl]oxirane
CID 88898601
2-[3-[2-(3-methoxypropoxy)ethoxy]propoxymethyl]oxirane
CID 101393644
1-methoxy-3-[4-(oxiran-2-ylmethoxy)butoxy]propan-2-ol;2-[4-(oxiran-2-ylmethoxy)butoxymethyl]oxirane
CID 162098827
2-(propan-2-yloxymethyl)oxirane
CID 159998967
2-(4-methoxybutoxymethyl)oxirane
CID 58151519

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-methoxyethoxy)-1-(oxiran-2-yl)ethoxy]methyl]oxirane?
The IUPAC name of 2-[[2-(2-methoxyethoxy)-1-(oxiran-2-yl)ethoxy]methyl]oxirane (CID 87386866) is 2-[[2-(2-methoxyethoxy)-1-(oxiran-2-yl)ethoxy]methyl]oxirane.
What is the SMILES notation for 2-[[2-(2-methoxyethoxy)-1-(oxiran-2-yl)ethoxy]methyl]oxirane?
The canonical SMILES for 2-[[2-(2-methoxyethoxy)-1-(oxiran-2-yl)ethoxy]methyl]oxirane is COCCOCC(OCC1CO1)C1CO1.
What is the InChIKey of 2-[[2-(2-methoxyethoxy)-1-(oxiran-2-yl)ethoxy]methyl]oxirane?
The InChIKey is PDZHNGYEALSGJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O5/c1-11-2-3-12-6-9(10-7-15-10)14-5-8-4-13-8/h8-10H,2-7H2,1H3.
What are the key properties of 2-[[2-(2-methoxyethoxy)-1-(oxiran-2-yl)ethoxy]methyl]oxirane?
2-[[2-(2-methoxyethoxy)-1-(oxiran-2-yl)ethoxy]methyl]oxirane has a molecular weight of 218.25 g/mol, XLogP of -0.17, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-methoxyethoxy)-1-(oxiran-2-yl)ethoxy]methyl]oxirane is sourced from PubChem (CID 87386866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).