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| IUPAC Name: | 4-(4-heptylphenyl)benzonitrile |
| Description: | 4'-Heptylbiphenyl-4-carbonitrile (CAS# 41122-71-8) is a useful research chemical. |
| Molecular Weight: | 277.40 |
| Molecular Formula: | C20H23N |
| Canonical SMILES: | CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N |
| InChI: | InChI=1S/C20H23N/c1-2-3-4-5-6-7-17-8-12-19(13-9-17)20-14-10-18(16-21)11-15-20/h8-15H,2-7H2,1H3 |
| InChI Key: | ZGOWXOZNUNZPAV-UHFFFAOYSA-N |
| Boiling Point: | 210-211 °C / 2 mmHg |
| Melting Point: | 36 °C |
| Flash Point: | 113 °C |
| Purity: | > 95.0 % (GC) |
| Density: | 1.01 g/cm3 |
| Appearance: | White or colorless to almost white or almost colorless powder to lump to clear liquid |
| MDL: | MFCD00074915 |
| LogP: | 5.73818 |
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(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
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