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CAS 886364-28-9

:

1,1-Dimethylethyl 8-fluoro-1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboxylate

Description:
1,1-Dimethylethyl 8-fluoro-1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboxylate, identified by its CAS number 886364-28-9, is a chemical compound that belongs to the benzodiazepine class, which is known for its psychoactive properties. This substance features a complex structure characterized by a benzodiazepine core, which includes a fused benzene and diazepine ring, along with a carboxylate ester functional group. The presence of a fluoro substituent at the 8-position contributes to its unique chemical reactivity and potential biological activity. The dimethyl group at the 1-position enhances its lipophilicity, which may influence its pharmacokinetic properties. Typically, compounds in this class are studied for their effects on the central nervous system, including anxiolytic, sedative, and muscle relaxant properties. However, specific biological activities, safety profiles, and therapeutic applications would require further investigation through empirical studies and clinical trials. As with all chemical substances, proper handling and safety measures should be observed due to potential toxicity or regulatory considerations.
Formula:C14H19FN2O2
InChI:InChI=1/C14H19FN2O2/c1-14(2,3)19-13(18)17-7-6-16-12-8-11(15)5-4-10(12)9-17/h4-5,8,16H,6-7,9H2,1-3H3
InChI key:InChIKey=LIRWIFCVEHXSFC-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)N1CC=2C(=CC(F)=CC2)NCC1
Synonyms:
  • 4H-1,4-Benzodiazepine-4-carboxylic acid, 8-fluoro-1,2,3,5-tetrahydro-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 8-fluoro-1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboxylate
  • 4-N-Boc-8-fluoro-1,2,3,5-tetrahydro-benzo[e][1,4]diazepine
  • tert-butyl 8-fluoro-2,3-dihydro-1H-benzo[e][1,4]diazepine-4(5H)-carboxylate
  • tert-Butyl 8-fluoro-1,2,3,5-tetrahydro-1,4-benzodiazepine-4-carboxylate
  • tert-Butyl 8-fluoro-1,2,3,5-tetrahydro-4H-benzo[e][1,4]diazepine-4-carboxylate
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