2-Methyl-5-phenyl-4-propargylisoxazolin-3-one

HCID 86752161
Substructure searchFind similar structures

Basic information

Standard SMILES
C#CCC1C(=O)N(C)OC1c1ccccc1
InChIKey
JLGZZNULGTYQLH-UHFFFAOYSA-N
Molecular formula
C13H13NO2
Average molar mass
215.25 g/mol

Names & identifiers

Preferred name
2-Methyl-5-phenyl-4-propargylisoxazolin-3-one
IUPAC
2-methyl-5-phenyl-4-prop-2-ynyl-1,2-oxazolidin-3-one

Names & synonyms

SCHEMBL8626560JLGZZNULGTYQLH-UHFFFAOYSA-N2-methyl-5-phenyl-4-propargylisoxazolin-3-one

Database identifiers

PubChem CID
86752161

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
29.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
16

Related reactions

2 records
New reaction record

Linked notes

Loading…