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Cas Database |
| Name |
2-(3-Piridyl)thiazolidine-4-carboxylic acid |
EINECS | N/A |
| CAS No. | 59777-95-6 | Density | 1.366 g/cm3 |
| PSA | 87.52000 | LogP | 1.19860 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C9H10N2O2S | Boiling Point | 468.2 °C at 760 mmHg |
| Molecular Weight | 210.257 | Flash Point | 237 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
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Hazard Symbols |
 Xi
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| Synonyms |
4-Thiazolidinecarboxylicacid, 2-(3-pyridyl)- (6CI);2-(3-Pyridyl)-4-carboxythiazolidine;2-Pyridin-3-yl-1,3-thiazolidine-4-carboxylic acid;NSC 303514; |
Article Data | 9 |
2-(3-Piridyl)thiazolidine-4-carboxylic acid Specification
The 4-Thiazolidinecarboxylicacid, 2-(3-pyridinyl)- with CAS registry number of 59777-95-6 is also known as 2-(3-Piridyl)thiazolidine-4-carboxylic acid. The IUPAC name is 2-Pyridin-3-yl-1,3-thiazolidine-4-carboxylic acid. In addition, the formula is C9H10N2O2S and the molecular weight is 210.25. What's more, this chemical may cause inflammation to the skin or other mucous membranes.
Physical properties about 4-Thiazolidinecarboxylicacid, 2-(3-pyridinyl)- are: (1)XLogP3-AA: -1.9; (2)H-Bond Donor: 2; (3)H-Bond Acceptor: 4; (4)Rotatable Bond Count: 2; (5)Exact Mass: 210.046298; (6)MonoIsotopic Mass: 210.046298; (7)Topological Polar Surface Area: 87.5; (8)Heavy Atom Count: 14; (9)Complexity: 225; (10)Undefined Atom StereoCenter Count: 2; (11)Covalently-Bonded Unit Count: 1.
You can still convert the following datas into molecular structure:
1. Canonical SMILES: C1C(NC(S1)C2=CN=CC=C2)C(=O)O
2. InChI: InChI=1S/C9H10N2O2S/c12-9(13)7-5-14-8(11-7)6-2-1-3-10-4-6/h1-4,7-8,11H,5H2,(H,12,13)
3. InChIKey: FSNGLHIMQHWTNF-UHFFFAOYSA-N
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