Keyword(s): Human Metabolites
Molecule Category Free-form
UNII 856X9KP929
EPA CompTox DTXSID7073224

Structure

InChI Key RPGWZZNNEUHDAQ-UHFFFAOYSA-N
Smiles Pc1ccccc1
InChI
InChI=1S/C6H7P/c7-6-4-2-1-3-5-6/h1-5H,7H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H7P1
Molecular Weight 110.03
AlogP 1.19
Heavy Atoms 7.0

Cross References

Resources Reference
CAS NUMBER 638-21-1
NORMAN SUSDAT
FDA SRS 856X9KP929
PubChem 12519
ChemSpider 12002.0