| Weight | 216.236 g/mol |
|---|---|
| Formula | C13H12O3 |
| Hydrogen Acceptors | 2 |
| Hydrogen Donors | 1 |
| Aromatic Rings | 1 |
| Rotatable Bonds | 3 |
(5-oxo-2-phenylcyclopent-1-en-1-yl)acetic acid (42882-19-9)
42882-19-9
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Predict GHS Hazards for Any Chemical in silico.
Including Acute Oral Tox, Skin Sensitization, Eye Irritation, Aquatic Tox, & more. - 42882-19-9
-
SMILESC1CC(=O)C(=C1C2=CC=CC=C2)CC(=O)O
-
InChIKeyGMVRVPYITUYSHB-UHFFFAOYSA-N
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Safety
Alternate Names
Estimated Properties
| Boiling Point | 330.91 C | EPA T.E.S.T. |
|---|---|---|
| Boiling Point | 378.28 C | EPI Suite |
| Density | 1.24 g/cm3 | EPA T.E.S.T. |
| Flash Point | 187 C | EPA T.E.S.T. |
| Melting Point | 137.63 C | EPI Suite |
| Water Solubility | 88.16 mg/L | EPA T.E.S.T. |
| Water Solubility | 534.7 mg/L | EPI Suite |
External Links
Synthesis
Reactant
+
(3-CHLOROPROPYL)BENZENE
(Grignard carbonyl)
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