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2-Acetylhydroquinone

PubChem CID: 10279

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Compound Synonyms 490-78-8, 2',5'-DIHYDROXYACETOPHENONE, 1-(2,5-Dihydroxyphenyl)ethanone, 2,5-Dihydroxyacetophenone, 2-Acetylhydroquinone, Quinacetophenone, Acetylhydroquinone, Ethanone, 1-(2,5-dihydroxyphenyl)-, Acetylquinol, 1-(2,5-dihydroxyphenyl)ethan-1-one, MFCD00002343, Acetophenone, 2',5'-dihydroxy-, 1-Acetyl-2,5-dihydroxybenzene, NSC 3759, 2,5-Dihydroxy-1-acetylbenzene, EINECS 207-716-4, K1H7QH11ZH, BRN 0637903, AI3-18221, NSC-3759, ghl.PD_Mitscher_leg0.355, 2', 5'-Dihydroxyacetophenone, 2-Acetyl-1,4-dihydroxybenzene, DTXSID9060077, 2,5-Dihydroxyphenyl methyl ketone, 2-ACETYL-1,4-BENZENEDIOL, 4-08-00-01803 (Beilstein Handbook Reference), UNII-K1H7QH11ZH, NSC3759, 2-acetyl hydroquinone, 2-acetyl-hydroquinone, monoacetyl hydroquinone, 2,5 -dihydroxyacetophenone, WLN: QR CQ BV1, 2,5-Dihydroxy acetophenone, Acetophenone,5'-dihydroxy-, 2`,5`-Dihydroxyacetophenone, Ethanone,5-dihydroxyphenyl)-, BIDD:ER0488, SCHEMBL108053, 2',5'-Dihydroxy-Acetophenone, CHEMBL2348532, DTXCID7040659, CHEBI:173647, 1-(2,5-dihydroxyphenyl)-ethanone, 2-ACETYLHYDROQUINONE [INCI], ALBB-019961, STR02363, 1-(2,5-dihydroxy-phenyl)-ethanone, 2',5'-Dihydroxyacetophenone, 97%, BBL027378, s9374, STL199230, AKOS000120785, CCG-266221, CS-W001174, FD36336, FS-3211, HY-W001174, 1-(2,5-Dihydroxyphenyl)ethanone, 9CI, s12309, AC-19701, SY011591, D1955, DHAP, 2-Acetylhydroquinone, Quinacetophenone, NS00031851, EN300-17127, AE-641/00693054, Q27281823, Z56889030, F3139-0239, 2 inverted exclamation mark ,5 inverted exclamation mark -Dihydroxyacetophenone, 207-716-4
Topological Polar Surface Area 57.5
Hydrogen Bond Donor Count 2.0
Heavy Atom Count 11.0
Isotope Atom Count 0.0
Molecular Complexity 155.0
Database Name cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count 0.0
Iupac Name 1-(2,5-dihydroxyphenyl)ethanone
Prediction Hob 1.0
Xlogp 1.7
Molecular Formula C8H8O3
Prediction Swissadme 0.0
Inchi Key WLDWSGZHNBANIO-UHFFFAOYSA-N
Fcsp3 0.125
Logs -1.52
Rotatable Bond Count 1.0
Logd 1.335
Compound Name 2-Acetylhydroquinone
Prediction Hob Swissadme 0.0
Exact Mass 152.047
Formal Charge 0.0
Monoisotopic Mass 152.047
Hydrogen Bond Acceptor Count 3.0
Molecular Weight 152.15
Covalent Unit Count 1.0
Total Atom Stereocenter Count 0.0
Total Bond Stereocenter Count 0.0
Esol -2.160460163636363
Inchi InChI=1S/C8H8O3/c1-5(9)7-4-6(10)2-3-8(7)11/h2-4,10-11H,1H3
Smiles CC(=O)C1=C(C=CC(=C1)O)O
Nring 1.0
Defined Bond Stereocenter Count 0.0