3-phenyl-1,3-oxazolidine-2,4-dione

C9H7NO3 — CID 10888463

IUPAC3-phenyl-1,3-oxazolidine-2,4-dione
SMILESO=C1COC(=O)N1c1ccccc1
InChIInChI=1S/C9H7NO3/c11-8-6-13-9(12)10(8)7-4-2-1-3-5-7/h1-5H,6H2
InChIKeyUOAVOZAOARIKEL-UHFFFAOYSA-N
MW177.16 g/mol
LogP1.17
Rot. Bonds1

About 3-phenyl-1,3-oxazolidine-2,4-dione

3-phenyl-1,3-oxazolidine-2,4-dione (PubChem CID 10888463) has the molecular formula C9H7NO3 and a molecular weight of 177.16 g/mol. Its IUPAC name is 3-phenyl-1,3-oxazolidine-2,4-dione.

Molecular Properties

Compound Name3-phenyl-1,3-oxazolidine-2,4-dione
PubChem CID10888463
Molecular FormulaC9H7NO3
Molecular Weight177.16 g/mol
Exact Mass177.04
IUPAC Name3-phenyl-1,3-oxazolidine-2,4-dione
SMILESO=C1COC(=O)N1c1ccccc1
InChIInChI=1S/C9H7NO3/c11-8-6-13-9(12)10(8)7-4-2-1-3-5-7/h1-5H,6H2
InChIKeyUOAVOZAOARIKEL-UHFFFAOYSA-N
XLogP1.17
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.16
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-phenyl-1,3-oxazolidine-2,4-dione?
The IUPAC name of 3-phenyl-1,3-oxazolidine-2,4-dione (CID 10888463) is 3-phenyl-1,3-oxazolidine-2,4-dione.
What is the SMILES notation for 3-phenyl-1,3-oxazolidine-2,4-dione?
The canonical SMILES for 3-phenyl-1,3-oxazolidine-2,4-dione is O=C1COC(=O)N1c1ccccc1.
What is the InChIKey of 3-phenyl-1,3-oxazolidine-2,4-dione?
The InChIKey is UOAVOZAOARIKEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7NO3/c11-8-6-13-9(12)10(8)7-4-2-1-3-5-7/h1-5H,6H2.
What are the key properties of 3-phenyl-1,3-oxazolidine-2,4-dione?
3-phenyl-1,3-oxazolidine-2,4-dione has a molecular weight of 177.16 g/mol, XLogP of 1.17, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-1,3-oxazolidine-2,4-dione is sourced from PubChem (CID 10888463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).