| Weight | 179.2 g/mol |
|---|---|
| Formula | C8H5NO2S |
| Hydrogen Acceptors | 4 |
| Hydrogen Donors | 0 |
| Aromatic Rings | 1 |
| Rotatable Bonds | 1 |
5-isothiocyanato-1,3-benzodioxole (113504-93-1)
113504-93-1
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Predict GHS Hazards for Any Chemical in silico.
Including Acute Oral Tox, Skin Sensitization, Eye Irritation, Aquatic Tox, & more. - 113504-93-1
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SMILESC1OC2=C(O1)C=C(C=C2)N=C=S
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InChIKeyUVVSPZKAEJHDCY-UHFFFAOYSA-N
Suppliers
Safety
Alternate Names
Estimated Properties
| Boiling Point | 277.63 C | EPA T.E.S.T. |
|---|---|---|
| Boiling Point | 292.99 C | EPI Suite |
| Density | 1.16 g/cm3 | EPA T.E.S.T. |
| Flash Point | 118.35 C | EPA T.E.S.T. |
| Melting Point | 81.16 C | EPI Suite |
| Water Solubility | 188 mg/L | EPA T.E.S.T. |
| Water Solubility | 14.152 mg/L | EPI Suite |
External Links
Similar Compounds
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5-isothiocyanato-1,3-benzodioxole
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