2-[1-(oxiran-2-yl)ethenoxymethyl]oxirane

C7H10O3 — CID 151123741

IUPAC2-[1-(oxiran-2-yl)ethenoxymethyl]oxirane
SMILESC=C(OCC1CO1)C1CO1
InChIInChI=1S/C7H10O3/c1-5(7-4-10-7)8-2-6-3-9-6/h6-7H,1-4H2
InChIKeyMSSYNIBBWQWLMQ-UHFFFAOYSA-N
MW142.15 g/mol
LogP0.31
Rot. Bonds4

About 2-[1-(oxiran-2-yl)ethenoxymethyl]oxirane

2-[1-(oxiran-2-yl)ethenoxymethyl]oxirane (PubChem CID 151123741) has the molecular formula C7H10O3 and a molecular weight of 142.15 g/mol. Its IUPAC name is 2-[1-(oxiran-2-yl)ethenoxymethyl]oxirane.

Molecular Properties

Compound Name2-[1-(oxiran-2-yl)ethenoxymethyl]oxirane
PubChem CID151123741
Molecular FormulaC7H10O3
Molecular Weight142.15 g/mol
Exact Mass142.06
IUPAC Name2-[1-(oxiran-2-yl)ethenoxymethyl]oxirane
SMILESC=C(OCC1CO1)C1CO1
InChIInChI=1S/C7H10O3/c1-5(7-4-10-7)8-2-6-3-9-6/h6-7H,1-4H2
InChIKeyMSSYNIBBWQWLMQ-UHFFFAOYSA-N
XLogP0.31
TPSA34.29 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.15
LogP ≤ 50.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', '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-[1-(oxiran-2-yl)ethenoxymethyl]oxirane?
The IUPAC name of 2-[1-(oxiran-2-yl)ethenoxymethyl]oxirane (CID 151123741) is 2-[1-(oxiran-2-yl)ethenoxymethyl]oxirane.
What is the SMILES notation for 2-[1-(oxiran-2-yl)ethenoxymethyl]oxirane?
The canonical SMILES for 2-[1-(oxiran-2-yl)ethenoxymethyl]oxirane is C=C(OCC1CO1)C1CO1.
What is the InChIKey of 2-[1-(oxiran-2-yl)ethenoxymethyl]oxirane?
The InChIKey is MSSYNIBBWQWLMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O3/c1-5(7-4-10-7)8-2-6-3-9-6/h6-7H,1-4H2.
What are the key properties of 2-[1-(oxiran-2-yl)ethenoxymethyl]oxirane?
2-[1-(oxiran-2-yl)ethenoxymethyl]oxirane has a molecular weight of 142.15 g/mol, XLogP of 0.31, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(oxiran-2-yl)ethenoxymethyl]oxirane is sourced from PubChem (CID 151123741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).