| Weight | 196.271 g/mol |
|---|---|
| Formula | C10H12O2S |
| Hydrogen Acceptors | 2 |
| Hydrogen Donors | 1 |
| Aromatic Rings | 1 |
| Rotatable Bonds | 5 |
3-(benzylthio)propanoic acid (2899-66-3)
2899-66-3
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- Sigma-Aldrich - 3-(benzylthio)propanoic acid128.75 USD
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Predict GHS Hazards for Any Chemical in silico.
Including Acute Oral Tox, Skin Sensitization, Eye Irritation, Aquatic Tox, & more. - 2899-66-3
-
SMILESC1=CC=C(C=C1)CSCCC(=O)O
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InChIKeyNDBNSZKHDMXOJE-UHFFFAOYSA-N
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Safety
Alternate Names
Estimated Properties
| Boiling Point | 316.35 C | EPA T.E.S.T. |
|---|---|---|
| Boiling Point | 336.73 C | EPI Suite |
| Density | 1.19 g/cm3 | EPA T.E.S.T. |
| Flash Point | 173.38 C | EPA T.E.S.T. |
| Melting Point | 105.54 C | EPI Suite |
| Water Solubility | 2543.75 mg/L | EPA T.E.S.T. |
| Water Solubility | 621.23 mg/L | EPI Suite |
External Links
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