| Identification | Back Directory | [Name]
3,6-DICHLORO-BENZO[B]THIOPHENE-2-CARBOXYLIC ACID | [CAS]
34576-94-8 | [Synonyms]
BT2
3,6-dichloro-2-benzothiophenecarboxylic acid
3,6-dichlorobenzothiophene-2-carboxylic acid
3,6-Dichloro-1-benzothiophene-2-carboxylicaci
Benzo[b]thiophene-2-carboxylic acid, 3,6-dichloro-
JR-6478, 3,6-Dichlorobenzo[b]thiophene-2-carboxylic acid, 97% | [Molecular Formula]
C9H4Cl2O2S | [MDL Number]
MFCD00781745 | [MOL File]
34576-94-8.mol | [Molecular Weight]
247.1 |
| Chemical Properties | Back Directory | [Boiling point ]
426.4±40.0 °C(Predicted) | [density ]
1.653±0.06 g/cm3(Predicted) | [storage temp. ]
Sealed in dry,2-8°C | [solubility ]
Soluble in DMSO (up to at least 20 mg/ml) | [form ]
solid | [pka]
2.09±0.30(Predicted) | [color ]
Off-white | [Stability:]
Stable for 1 year from date of purchase as supplied. Solutions in DMSO may be stored at -20°C for up to 3 months. |
| Hazard Information | Back Directory | [Description]
3,6-dichloro-benzo[b]thiophene-2-Carboxylic acid is an inhibitor of myeloid cell leukemia 1 (Mcl-1) with a Ki value of 59 μM for binding of FITC-Mcl-1-BH2 peptide binding to Mcl-1.1 It has been used as a building block in the synthesis of inhibitors of Mcl-1, the toll-like receptor 3/double-stranded RNA (TLR3/dsRNA) complex, and D-amino acid oxidase (DAO).1,2,3 | [storage]
Store at -20°C | [References]
1) Tso et al. (2014), Benzothiophene carboxylate derivatives as novel allosteric inhibitors of branched-chain α-ketoacid dehydrogenase kinase; J. Biol. Chem., 289 20583
2) Friberg et al. (2013), Discovery of potent myeloid cell leukemia (Mcl 1) inhibitors using fragment based methods and structure based design; J. Med. Chem. 56 15 |
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