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| IUPAC Name: | 2-chloro-3,4-dimethoxybenzaldehyde |
| Description: | 2-Chloro-3,4-dimethoxybenzaldehyde (CAS# 5417-17-4) is a useful reagent in the synthesis of the human TLR4 agonist euodenine A. 2-Chloro-3,4-dimethoxybenzaldehyde is also used as a reagent in the synthesis of novel 2-methoxyacylhydrazones as potent, selective PDE10A inhibitors with activity in animal models of schizophrenia. |
| Molecular Weight: | 200.62 |
| Molecular Formula: | C9H9ClO3 |
| Canonical SMILES: | COC1=C(C(=C(C=C1)C=O)Cl)OC |
| InChI: | InChI=1S/C9H9ClO3/c1-12-7-4-3-6(5-11)8(10)9(7)13-2/h3-5H,1-2H3 |
| InChI Key: | SAWHDJTZESXNMM-UHFFFAOYSA-N |
| Boiling Point: | 300.9 °C at 760 mmHg |
| Melting Point: | 69-73 °C |
| Purity: | 95 % |
| Density: | 1.245 g/cm3 |
| Appearance: | Beige-yellow to beige crystalline powder |
| MDL: | MFCD00084942 |
| LogP: | 2.16970 |
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