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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 86752161Generated: October 23, 2026

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

https://huagongshe.com/en/chemical/86752161

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

Identifiers & Physical Properties

Molecular formulaC13H13NO2
Average molar mass215.25 g/mol
SMILESC#CCC1C(=O)N(C)OC1c1ccccc1
InChIKeyJLGZZNULGTYQLH-UHFFFAOYSA-N
PubChem CID86752161

Chemical & Physical Properties

XLogP1.6
Topological polar surface area29.5
Hydrogen bond donors0
Hydrogen bond acceptors2
Rotatable bonds2
Heavy atoms16
Formal charge0
Complexity311