| Weight | 196.227 g/mol |
|---|---|
| Formula | C9H8O3S |
| Hydrogen Acceptors | 3 |
| Hydrogen Donors | 1 |
| Aromatic Rings | 1 |
| Rotatable Bonds | 1 |
7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid (96334-46-2)
96334-46-2
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- Sigma-Aldrich - Search for 7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
- Fisher Scientific - Search for 7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
- TCI - Search for 7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
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Predict GHS Hazards for Any Chemical in silico.
Including Acute Oral Tox, Skin Sensitization, Eye Irritation, Aquatic Tox, & more. - 96334-46-2
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SMILESC1CC2=C(C(=O)C1)SC=C2C(=O)O
-
InChIKeyDIHMRAKCRQYYNP-UHFFFAOYSA-N
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Safety
Alternate Names
Estimated Properties
| Boiling Point | 349.49 C | EPA T.E.S.T. |
|---|---|---|
| Boiling Point | 360.19 C | EPI Suite |
| Density | 1.4 g/cm3 | EPA T.E.S.T. |
| Flash Point | 169.12 C | EPA T.E.S.T. |
| Melting Point | 136.76 C | EPI Suite |
| Water Solubility | 3373.67 mg/L | EPA T.E.S.T. |
| Water Solubility | 2380.2 mg/L | EPI Suite |
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