Keyword(s): Human Metabolites
Molecule Category Free-form
UNII I9OW1NLY9R
EPA CompTox DTXSID0047745

Structure

InChI Key HFHFGHLXUCOHLN-UHFFFAOYSA-N
Smiles FC=1C=CC=CC1O
InChI
InChI=1/C6H5FO/c7-5-3-1-2-4-6(5)8/h1-4,8H

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H5FO
Molecular Weight 112.03
AlogP 1.53
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Polar Surface Area 20.23
Heavy Atoms 8.0

Cross References

Resources Reference
CAS NUMBER 367-12-4
NORMAN SUSDAT
FDA SRS I9OW1NLY9R
PubChem 9707