Keyword(s): Human Metabolites
Molecule Category Free-form
UNII VQ093653DO
EPA CompTox DTXSID5023247

Structure

InChI Key ZJTLZYDQJHKRMQ-UHFFFAOYSA-N
Smiles Cc1cc(O)c2ccccc2c1O
InChI
InChI=1S/C11H10O2/c1-7-6-10(12)8-4-2-3-5-9(8)11(7)13/h2-6,12-13H,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H10O2
Molecular Weight 174.07
AlogP 2.56
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 2.0
Polar Surface Area 40.46
Heavy Atoms 13.0

Cross References

Resources Reference
CAS NUMBER 481-85-6
NORMAN SUSDAT
FDA SRS VQ093653DO
PubChem 10209
ChemSpider 9794.0