| Identification | Back Directory | [Name]
3-OXOHEXANEDIOIC ACID | [CAS]
689-31-6 | [Synonyms]
NSC18511
3-ketoadipate
3-oxoadipic acid
B-ketoadipic acid
3-OXOHEXANEDIOIC ACID
4-OXOHEXANEDIOIC ACID
Hexanedioic acid, 3-oxo-
β-Ketoadipic acid, 3-Oxohexanedioic acid | [Molecular Formula]
C6H8O5 | [MDL Number]
MFCD00010003 | [MOL File]
689-31-6.mol | [Molecular Weight]
160.12 |
| Chemical Properties | Back Directory | [Melting point ]
124-126 °C(lit.)
| [Boiling point ]
412.2±25.0 °C(Predicted) | [density ]
1.405±0.06 g/cm3(Predicted) | [storage temp. ]
−20°C
| [solubility ]
Acetonitrile (Slightly), DMSO (Slightly), Methanol (Slightly) | [form ]
Solid | [pka]
3.13±0.32(Predicted) | [color ]
White to Off-White | [LogP]
-0.688 (est) |
| Hazard Information | Back Directory | [Uses]
3-Oxohexanedioic Acid is a degradation product of catechol in the presence of hydrogen peroxide; Also, it is derived from 3-Oxohexanedioic Acid Diethyl Ester (O856830), which is an intermediate used to prepare CMPF (C595000) which is a drug-binding inhibitor which is also a constituent of urine. CMPF can inhibit specific T4 binding in serum by increasing the free concentration of direct competitors. | [Definition]
ChEBI: An oxo dicarboxylic acid consisting of adipic acid having a single oxo group at the 3-position. |
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