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| IUPAC Name: | 2-pyren-1-ylacetic acid |
| Description: | 1-Pyreneacetic acid (CAS# 64709-55-3 ) is a useful research chemical. |
| Molecular Weight: | 260.29 |
| Molecular Formula: | C18H12O2 |
| Canonical SMILES: | C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CC(=O)O |
| InChI: | InChI=1S/C18H12O2/c19-16(20)10-14-7-6-13-5-4-11-2-1-3-12-8-9-15(14)18(13)17(11)12/h1-9H,10H2,(H,19,20) |
| InChI Key: | SDJCLYBBPUHKCD-UHFFFAOYSA-N |
| Boiling Point: | 500.2 °C at 760 mmHg |
| Density: | 1.374 g/cm3 |
| MDL: | MFCD00192422 |
| LogP: | 4.21110 |
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(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
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