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Substance Name: alpha-Fluoro-beta-alanine
RN: 3821-81-6
UNII: 1461S5575Q
InChIKey: OJQNRNQELNLWHH-UHFFFAOYSA-N

Note

  • Metabolite of HCFU & 5-fluorouracil.

Molecular Formula

  • C3-H6-F-N-O2

Molecular Weight

  • 107.083
 
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Names and Synonyms

Name of Substance

  • alpha-Fluoro-beta-alanine

Synonyms

  • EINECS 223-318-3
  • UNII-1461S5575Q

Systematic Name

  • 3-Amino-2-fluoropropionic acid

Registry Numbers

CAS Registry Number

  • 3821-81-6

FDA UNII

  • 1461S5575Q

Related Registry Number

  • 867-84-5 (hydrochloride)

System Generated Number

  • 0003821816

Structure Descriptors

InChI

1S/C3H6FNO2/c4-2(1-5)3(6)7/h2H,1,5H2,(H,6,7)

InChIKey

OJQNRNQELNLWHH-UHFFFAOYSA-N

Smiles

C([C@@H](F)CN)(=O)O