benzene-1,2-diol; ethane-1,2-diamine; hydrate

Systemtic Name: benzene-1,2-diol; ethane-1,2-diamine; hydrate Openeye Name: benzene-1,2-diol; ethane-1,2-diamine; hydrate CAS Name: benzene-1,2-diol; ethane-1,2-diamine; hydrate IUPAC Name: benzene-1,2-diol; ethane-1,2-diamine; hydrate Traditional Name: 2-aminoethylamine; pyrocatechol; hydrate Formula: C8H16N2O3 MolecularWeight: 188.22424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H6O2.C2H8N2.H2O/c7-5-3-1-2-4-6(5)8;3-1-2-4;/h1-4,7-8H;1-4H2;1H2