Compound: 1,2,4-BENZENETRIOL
SMILES: Oc1c(O)ccc(c1)O
InChIKey: GGNQRNBDZQJCCN-UHFFFAOYSA-N
Synonyms: 1,2,4-BENZENETRIOL, Benzene-1,2,4-triol, 533-73-3, 1,2,4-Trihydroxybenzene, Hydroxyhydroquinone, Hydroxyquinol, 4-Hydroxycatechol, DTXSID3040930, IMEXINE OAM, 173O8B04RD, NSC-2818, CHEBI:16971, RefChem:71511, DTXCID1020930, 208-575-1, Oxyhydroquinone, 2,5-Dihydroxyphenol, Oxyhydrochinon, Hydroquinone, hydroxy-, 1,3,4-Trihydroxybenzene, 1,3,4-Benzenetriol, MFCD00002198, NSC 2818, Oxyhydrochinon [German], CCRIS 2987, EINECS 208-575-1, BRN 2042863, UNII-173O8B04RD, AI3-19361, 1,4-Benzenetriol, Benzene-1,4-triol, 1,4-Trihydroxybenzene, monohydroxy hydroquinone, Phloroglucinol Impurity E, WLN: QR BQ DQ, bmse000831, 1,2,4-trihydroxy benzene, Phloroglucinol Impurity 17, SCHEMBL33527, 2-Hydroxy-1,4-hydroquinone, 2-Hydroxy-p-benzohydroquinone, 4-06-00-07338 (Beilstein Handbook Reference), SCHEMBL132653, SCHEMBL133807, orb1692656, SCHEMBL2115480, SCHEMBL4816089, SCHEMBL5542880, SCHEMBL7014577, CHEMBL3092389, SCHEMBL29829218, NSC2818, 1,2,4-BENZENETRIOL [MI], 1,2,4-Benzenetriol technical grade, c0264, EBC-03101, AKOS015889832, CS-W011167, DS-8585, FB18185, HY-W010451, AC-12373, SY004215, DB-018727, 1,2,4-Benzenetriol, ReagentPlus(R), 99%, H0249, NS00001197, C02814, EN300-141499, F386711, Q903332, 1,2,4-Benzenetriol, Vetec(TM) reagent grade, 98%, 1,2,4-Trihydroxybenzene(Discontinued,See C4X-221717), Z1255438414, InChI=1/C6H6O3/c7-4-1-2-5(8)6(9)3-4/h1-3,7-9, 1,3,4-Benzenetriol,1,2,4-Trihydroxybenzene, 2-Hydroxy-p-benzohydroquinone, Phloroglucinol Anhydrous Imp. E (EP), 1,2,4-Benzenetriol, 2-Hydroxyhydroquinone, HHQ, NSC 2818, 1,3,4-Trihydroxybenzene, 2-Hydroxy-1,4-hydroquinone, 2,5-Dihydroxyphenol, Hydroxyhydroquinone, 4-Hydroxycatechol, 4-Hydroxycatechol, 2-Hydroxy-p-benzohydroquinone, 2-Hydroxy-1,4-hydroquinone, Phloroglucinol Anhydrous Imp. E (EP), NSC 2818,1,2,4-Trihydroxybenzene, 2,5-Dihydroxyphenol, 1,2,4-Benzenetriol, 1,3,4-Trihydroxybenzene, HHQ, 2-Hydroxyhydroquinone, 1,3,4-Benzenetriol, Hydroxyhydroquinone, HQN
Theoretical properties:
molecular_formula: C6H6O3
molecular_weight: 126.11 g/mol
exact_mass: 126.031694049 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 3
hydrogen_bond_acceptor_count: 3
rotatable_bond_count: 0
heavy_atom_count: 9
topological_polar_surface_area: 60.7 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
pubchem: Benzene-1,2,4-triol is a benzenetriol carrying hydroxy groups at positions 1, 2 and 4. It has a role as a mouse metabolite.
chebi: A benzenetriol carrying hydroxy groups at positions 1, 2 and 4.
chembl: Unnamed Compound is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: Phloroglucinol is an organic compound with the formula C6H3(OH)3. It is a colorless solid. It is used in the synthesis of pharmaceuticals and explosives. Phloroglucinol is one of three isomeric benzenetriols. The other two isomers are hydroxyquinol (1,2,4-benzenetriol) and pyrogallol (1,2,3-benzenetriol).  Phloroglucinol, and its benzenetriol isomers, are still defined as "phenols" according to the IUPAC official nomenclature rules of chemical compounds. Many such monophenolics are often termed polyphenols. The enzyme is biosynthesized by phloroglucinol synthase.