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| IUPAC Name: | 4-ethynylbenzonitrile |
| Description: | 4-Ethynylbenzonitrile (CAS# 3032-92-6) is a useful research chemical. |
| Molecular Weight: | 127.14 |
| Molecular Formula: | C9H5N |
| Canonical SMILES: | C#CC1=CC=C(C=C1)C#N |
| InChI: | InChI=1S/C9H5N/c1-2-8-3-5-9(7-10)6-4-8/h1,3-6H |
| InChI Key: | LAGNMUUUMQJXBF-UHFFFAOYSA-N |
| Boiling Point: | 230.2 °C at 760 mmHg |
| Melting Point: | 156-160 °C (lit.) |
| Purity: | ≥ 97 % |
| Density: | 1.08 g/cm3 |
| Appearance: | White to dark tan powder or crystals |
| MDL: | MFCD04974058 |
| LogP: | 1.53958 |
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