phenol hydrate

Systemtic Name: phenol hydrate Openeye Name: phenol hydrate CAS Name: phenol hydrate IUPAC Name: phenol hydrate Traditional Name: phenol hydrate Formula: C12H14O3 MolecularWeight: 206.23776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)O.C1=CC=C(C=C1)O.O

Isomeric SMILES

C1=CC=C(C=C1)O.C1=CC=C(C=C1)O.O

InChI

InChI=1S/2C6H6O.H2O/c2*7-6-4-2-1-3-5-6;/h2*1-5,7H;1H2