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| IUPAC Name: | 2-methyl-4-nitrobenzonitrile |
| Description: | 2-Methyl-4-nitrobenzonitrile (CAS# 89001-53-6) is a useful research chemical compound. |
| Molecular Weight: | 162.15 |
| Molecular Formula: | C8H6N2O2 |
| Canonical SMILES: | CC1=C(C=CC(=C1)[N+](=O)[O-])C#N |
| InChI: | InChI=1S/C8H6N2O2/c1-6-4-8(10(11)12)3-2-7(6)5-9/h2-4H,1H3 |
| InChI Key: | RNTFKDBRMXYEPR-UHFFFAOYSA-N |
| Boiling Point: | 329.603 °C at 760 mmHg |
| Melting Point: | 100-103 °C (lit.) |
| Purity: | 95 % |
| Density: | 1.264 g/cm3 |
| Appearance: | White to light yellow crystal powder |
| MDL: | MFCD03095378 |
| LogP: | 2.29808 |
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