hydron;oxirane

C2H5O+ — CID 21282223

IUPAChydron;oxirane
SMILESC1CO1.[H+]
InChIInChI=1S/C2H4O/c1-2-3-1/h1-2H2/p+1
InChIKeyIAYPIBMASNFSPL-UHFFFAOYSA-O
MW45.06 g/mol
LogP0.13
Rot. Bonds

About hydron;oxirane

hydron;oxirane (PubChem CID 21282223) has the molecular formula C2H5O+ and a molecular weight of 45.06 g/mol. Its IUPAC name is hydron;oxirane.

Molecular Properties

Compound Namehydron;oxirane
PubChem CID21282223
Molecular FormulaC2H5O+
Molecular Weight45.06 g/mol
Exact Mass45.03
IUPAC Namehydron;oxirane
SMILESC1CO1.[H+]
InChIInChI=1S/C2H4O/c1-2-3-1/h1-2H2/p+1
InChIKeyIAYPIBMASNFSPL-UHFFFAOYSA-O
XLogP0.13
TPSA12.53 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50045.06
LogP ≤ 50.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 hydron;oxirane?
The IUPAC name of hydron;oxirane (CID 21282223) is hydron;oxirane.
What is the SMILES notation for hydron;oxirane?
The canonical SMILES for hydron;oxirane is C1CO1.[H+].
What is the InChIKey of hydron;oxirane?
The InChIKey is IAYPIBMASNFSPL-UHFFFAOYSA-O. The full InChI is InChI=1S/C2H4O/c1-2-3-1/h1-2H2/p+1.
What are the key properties of hydron;oxirane?
hydron;oxirane has a molecular weight of 45.06 g/mol, XLogP of 0.13, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;oxirane is sourced from PubChem (CID 21282223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).