| Weight | 226.341 g/mol |
|---|---|
| Formula | C12H18O2S |
| Hydrogen Acceptors | 2 |
| Hydrogen Donors | 1 |
| Aromatic Rings | 0 |
| Rotatable Bonds | 3 |
(1-ADAMANTYLTHIO)ACETIC ACID (95769-28-1)
95769-28-1
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Predict GHS Hazards for Any Chemical in silico.
Including Acute Oral Tox, Skin Sensitization, Eye Irritation, Aquatic Tox, & more. - 95769-28-1
-
SMILESC1C2CC3CC1CC(C2)(C3)SCC(=O)O
-
InChIKeyDMZIQLZIXCFDQQ-UHFFFAOYSA-N
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Safety
Alternate Names
Estimated Properties
| Boiling Point | 290.84 C | EPA T.E.S.T. |
|---|---|---|
| Boiling Point | 343.11 C | EPI Suite |
| Density | 1.17 g/cm3 | EPA T.E.S.T. |
| Flash Point | 152.79 C | EPA T.E.S.T. |
| Melting Point | 119.21 C | EPI Suite |
| Water Solubility | 933.64 mg/L | EPA T.E.S.T. |
| Water Solubility | 100.13 mg/L | EPI Suite |
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