Keyword(s): Human Metabolites
Molecule Category Free-form
UNII U9IF5Y5IND
EPA CompTox DTXSID00171224

Structure

InChI Key USFPINLPPFWTJW-UHFFFAOYSA-N
Smiles c1ccc(cc1)[P+](c1ccccc1)(c1ccccc1)c1ccccc1
InChI
InChI=1S/C24H20P/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H/q+1

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H20P1
Molecular Weight 339.13
AlogP 4.31
Number of Rotational Bond 4.0
Heavy Atoms 25.0

Cross References

Resources Reference
CAS NUMBER 18198-39-5
NORMAN SUSDAT
FDA SRS U9IF5Y5IND
PubChem 164912
ChemSpider 144578.0