Keyword(s): Human Metabolites
Molecule Category Free-form
UNII 05G6U0TXS3
EPA CompTox DTXSID20166591

Structure

InChI Key AZFQCTBZOPUVOW-UHFFFAOYSA-N
Smiles C[P+](c1ccccc1)(c1ccccc1)c1ccccc1
InChI
InChI=1S/C19H18P/c1-20(17-11-5-2-6-12-17,18-13-7-3-8-14-18)19-15-9-4-10-16-19/h2-16H,1H3/q+1

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H18P1
Molecular Weight 277.11
AlogP 3.61
Number of Rotational Bond 3.0
Heavy Atoms 20.0

Cross References

Resources Reference
CAS NUMBER 15912-74-0
NORMAN SUSDAT
FDA SRS 05G6U0TXS3
PubChem 74506
ChemSpider 67087.0