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CAS 123053-42-9

:

1H-Azepine-2-carboxylic acid, hexahydro-, hydrochloride (1:1), (2S)-

Description:
1H-Azepine-2-carboxylic acid, hexahydro-, hydrochloride (1:1), (2S)- is a chemical compound characterized by its cyclic structure, specifically a seven-membered ring containing nitrogen, which classifies it as a heterocyclic compound. The presence of a carboxylic acid functional group indicates that it can participate in various chemical reactions, such as esterification or amidation. The hexahydro designation suggests that the compound is fully saturated, meaning it contains no double bonds within the ring structure. The hydrochloride form indicates that the compound is in its salt form, which often enhances its solubility in water and stability. The (2S)- notation refers to the specific stereochemistry of the molecule, indicating that it has a particular spatial arrangement of its atoms, which can influence its biological activity and interactions. This compound may have applications in pharmaceuticals or organic synthesis, although specific uses would depend on its biological properties and reactivity. As with many chemical substances, safety data and handling precautions should be considered when working with it.
Formula:C7H13NO2·ClH
InChI:InChI=1S/C7H13NO2.ClH/c9-7(10)6-4-2-1-3-5-8-6;/h6,8H,1-5H2,(H,9,10);1H/t6-;/m0./s1
InChI key:InChIKey=ZLLUTYACBSEHCT-RGMNGODLSA-N
SMILES:C(O)(=O)[C@@H]1CCCCCN1.Cl
Synonyms:
  • (s)Hexahydro-1H-azepine-2-carboxylic acid hydrochloride
  • 1H-Azepine-2-carboxylic acid, hexahydro-, hydrochloride (1:1), (2S)-
  • (2S)-Azepane-2-carboxylic acid hydrochloride
  • 1H-Azepine-2-carboxylic acid, hexahydro-, hydrochloride, (S)-
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