Se-phenyl 2-oxo-1,3-oxazolidine-3-carboselenoate

C10H9NO3Se — CID 11054726

IUPACSe-phenyl 2-oxo-1,3-oxazolidine-3-carboselenoate
SMILESO=C1OCCN1C(=O)[Se]c1ccccc1
InChIInChI=1S/C10H9NO3Se/c12-9-11(6-7-14-9)10(13)15-8-4-2-1-3-5-8/h1-5H,6-7H2
InChIKeyQQYPYKBZGHMQFV-UHFFFAOYSA-N
MW270.15 g/mol
LogP0.59
Rot. Bonds2

About Se-phenyl 2-oxo-1,3-oxazolidine-3-carboselenoate

Se-phenyl 2-oxo-1,3-oxazolidine-3-carboselenoate (PubChem CID 11054726) has the molecular formula C10H9NO3Se and a molecular weight of 270.15 g/mol. Its IUPAC name is Se-phenyl 2-oxo-1,3-oxazolidine-3-carboselenoate.

Molecular Properties

Compound NameSe-phenyl 2-oxo-1,3-oxazolidine-3-carboselenoate
PubChem CID11054726
Molecular FormulaC10H9NO3Se
Molecular Weight270.15 g/mol
Exact Mass270.97
IUPAC NameSe-phenyl 2-oxo-1,3-oxazolidine-3-carboselenoate
SMILESO=C1OCCN1C(=O)[Se]c1ccccc1
InChIInChI=1S/C10H9NO3Se/c12-9-11(6-7-14-9)10(13)15-8-4-2-1-3-5-8/h1-5H,6-7H2
InChIKeyQQYPYKBZGHMQFV-UHFFFAOYSA-N
XLogP0.59
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.15
LogP ≤ 50.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of Se-phenyl 2-oxo-1,3-oxazolidine-3-carboselenoate?
The IUPAC name of Se-phenyl 2-oxo-1,3-oxazolidine-3-carboselenoate (CID 11054726) is Se-phenyl 2-oxo-1,3-oxazolidine-3-carboselenoate.
What is the SMILES notation for Se-phenyl 2-oxo-1,3-oxazolidine-3-carboselenoate?
The canonical SMILES for Se-phenyl 2-oxo-1,3-oxazolidine-3-carboselenoate is O=C1OCCN1C(=O)[Se]c1ccccc1.
What is the InChIKey of Se-phenyl 2-oxo-1,3-oxazolidine-3-carboselenoate?
The InChIKey is QQYPYKBZGHMQFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO3Se/c12-9-11(6-7-14-9)10(13)15-8-4-2-1-3-5-8/h1-5H,6-7H2.
What are the key properties of Se-phenyl 2-oxo-1,3-oxazolidine-3-carboselenoate?
Se-phenyl 2-oxo-1,3-oxazolidine-3-carboselenoate has a molecular weight of 270.15 g/mol, XLogP of 0.59, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for Se-phenyl 2-oxo-1,3-oxazolidine-3-carboselenoate is sourced from PubChem (CID 11054726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).