Keyword(s): Human Metabolites
Molecule Category Free-form

Structure

InChI Key UHOVQNZJYSORNB-MICDWDOJSA-N
Smiles [2H]C1=CC=CC=C1
InChI
InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H/i1D

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H6
Molecular Weight 79.05
AlogP 1.69
Heavy Atoms 6.0

Cross References

Resources Reference
CAS NUMBER 1120-89-4
NORMAN SUSDAT