(Z)-2-(5-benzylidene-4-oxo-2-thioxothiazolidin-3-yl)acetic acid
- CAS NO.：1151944-57-8
- Empirical Formula: C12H9NO3S2
- Molecular Weight: 279.33
- MDL number: MFCD00586668
- Update Date: 2024-04-12 23:00:50
Properties of (Z)-2-(5-benzylidene-4-oxo-2-thioxothiazolidin-3-yl)acetic acid
| Melting point: |
247-248 °C(Solv: acetic acid (64-19-7))
|
| Boiling point: |
482.0±55.0 °C(Predicted)
|
| Density |
1.54±0.1 g/cm3(Predicted)
|
| pka |
3.62±0.10(Predicted)
|
| InChI |
InChI=1S/C12H9NO3S2/c14-10(15)7-13-11(16)9(18-12(13)17)6-8-4-2-1-3-5-8/h1-6H,7H2,(H,14,15)/b9-6-
|
Safety information for (Z)-2-(5-benzylidene-4-oxo-2-thioxothiazolidin-3-yl)acetic acid
Computed Descriptors for (Z)-2-(5-benzylidene-4-oxo-2-thioxothiazolidin-3-yl)acetic acid
| InChIKey |
CMANXDDFFAZWJR-TWGQIWQCSA-N
|
| SMILES |
S1/C(=C\C2=CC=CC=C2)/C(=O)N(CC(O)=O)C1=S
|
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