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L-(2S,3aR,7aS)-Octahydroindole-2-carboxylic Acid , CAS No.145438-94-4
Basic Description
Synonyms | 145438-94-4 | (2S,3aR,7aS)-Octahydro-1H-indole-2-carboxylic acid | (2S,3aR,7aS)-Octahydroindole-2-carboxylic acid | 87679-58-1 | (2S,3AR,7AS)-OCTAHYDRO-INDOLE-2-CARBOXYLIC ACID | (2S,3AR,7aS)-rel-octahydro-1H-indole-2-carboxylic acid | 1H-Indole-2-carboxylic acid, oc |
Storage Temp | Store at 2-8°C |
Shipped In | Wet ice |
Product Description | A Trandolapril intermediate. |
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Names and Identifiers
IUPAC Name | (2S,3aR,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxylic acid |
INCHI | InChI=1S/C9H15NO2/c11-9(12)8-5-6-3-1-2-4-7(6)10-8/h6-8,10H,1-5H2,(H,11,12)/t6-,7+,8+/m1/s1 |
InChi Key | CQYBNXGHMBNGCG-CSMHCCOUSA-N |
Canonical SMILES | C1CCC2C(C1)CC(N2)C(=O)O |
Isomeric SMILES | C1CC[C@H]2[C@H](C1)C[C@H](N2)C(=O)O |
PubChem CID | 7018901 |
Molecular Weight | 169.22 |
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Chemical and Physical Properties
Solubility | Soluble in Methanol (sparingly) |
Melt Point(°C) | 307-309°C (lit.)(dec.) |
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