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| IUPAC Name: | 2-(1,3,2-dioxaborinan-2-yl)benzonitrile |
| Description: | 2-Cyanophenylboronic Acid 1,3-Propanediol Ester (CAS# 172732-52-4) is used in the synthesis of AMPA receptor antagonists in the treatment of neurological diseases causing dysfunction of glutamatergic neurotransmission. Also used in the small scale synthesis of Perampanel (P285520), an AMPA receptor antagonist. |
| Molecular Weight: | 187.00 |
| Molecular Formula: | C10H10NO2B |
| Canonical SMILES: | B1(OCCCO1)C2=CC=CC=C2C#N |
| InChI: | InChI=1S/C10H10BNO2/c12-8-9-4-1-2-5-10(9)11-13-6-3-7-14-11/h1-2,4-5H,3,6-7H2 |
| InChI Key: | REQZFVYFYAZUMG-UHFFFAOYSA-N |
| Boiling Point: | 372.4 °C at 760 mmHg |
| Melting Point: | 46-56 °C (lit.) |
| Purity: | 96 % |
| Density: | 1.13 g/cm3 |
| MDL: | MFCD04039012 |
| LogP: | 0.69038 |
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