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CAS 1818843-18-3

:

Carbamic acid, N-[[(2R,4S)-4-fluoro-2-pyrrolidinyl]methyl]-, 1,1-dimethylethyl ester, hydrochloride (1:1)

Description:
Carbamic acid, N-[[(2R,4S)-4-fluoro-2-pyrrolidinyl]methyl]-, 1,1-dimethylethyl ester, hydrochloride (1:1), with CAS number 1818843-18-3, is a chemical compound characterized by its unique structure that includes a carbamic acid moiety and a pyrrolidine ring. This compound features a fluorine atom, which can influence its biological activity and chemical reactivity. The presence of the 1,1-dimethylethyl ester group contributes to its stability and solubility properties. As a hydrochloride salt, it is typically more soluble in water compared to its free base form, which is advantageous for pharmaceutical applications. The specific stereochemistry indicated by the (2R,4S) configuration suggests that the compound may exhibit chiral properties, potentially affecting its interaction with biological targets. Overall, this compound may have applications in medicinal chemistry, particularly in the development of therapeutics, due to its structural features that can modulate biological activity.
Formula:C10H19FN2O2·ClH
InChI:InChI=1S/C10H19FN2O2.ClH/c1-10(2,3)15-9(14)13-6-8-4-7(11)5-12-8;/h7-8,12H,4-6H2,1-3H3,(H,13,14);1H/t7-,8+;/m0./s1
InChI key:InChIKey=ZFUOQMCJMKAZMC-KZYPOYLOSA-N
SMILES:C(NC(OC(C)(C)C)=O)[C@H]1C[C@H](F)CN1.Cl
Synonyms:
  • tert-Butyl N-[[(2R,4S)-4-fluoropyrrolidin-2-yl]methyl]carbamate hydrochloride
  • Carbamic acid, N-[[(2R,4S)-4-fluoro-2-pyrrolidinyl]methyl]-, 1,1-dimethylethyl ester, hydrochloride (1:1)
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