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Home >> Chemical Listing >> Page 1833 >> Oxepinac

Oxepinac
[CAS# 55689-65-1]

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Identification
Name Oxepinac
Synonyms 2-(11-Keto-6H-Benzo[C][2]Benzoxepin-3-Yl)Acetic Acid; 2-(11-Oxo-6H-Benzo[C][2]Benzoxepin-3-Yl)Ethanoic Acid; 5-18-08-00459 (Beilstein Handbook Reference)
Molecular Structure CAS#: 55689-65-1, Oxepinac
Molecular Formula C16H12O4
Molecular Weight 268.27
CAS Registry Number 55689-65-1
SMILES C1=CC(=CC3=C1C(C2=C(C=CC=C2)CO3)=O)CC(O)=O
InChI 1S/C16H12O4/c17-15(18)8-10-5-6-13-14(7-10)20-9-11-3-1-2-4-12(11)16(13)19/h1-7H,8-9H2,(H,17,18)
InChIKey PYIHCGFQQSKYBO-UHFFFAOYSA-N
Properties
Density 1.349g/cm3 (Cal.)
Boiling point 525.456°C at 760 mmHg (Cal.)
Flash point 202.637°C (Cal.)
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