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Substance Name: Benzo(6,7)cyclohept(1,2-b)(1,4)oxazine, 2,3,4,4a,5,6,7,11b-octahydro-10-fluoro-, (E)-
RN: 105124-48-9
InChIKey: LCKGQBWTFHRKJB-STQMWFEESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H16-F-N-O

Molecular Weight

  • 221.2734
 
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Names and Synonyms

Synonym

  • (E)-2,3,4,4a,5,6,7,11b-Octahydro-10-fluorobenzo(6,7)cyclohept(1,2-b)(1,4)oxazine

Systematic Name

  • Benzo(6,7)cyclohept(1,2-b)(1,4)oxazine, 2,3,4,4a,5,6,7,11b-octahydro-10-fluoro-, (E)-

Registry Numbers

CAS Registry Number

  • 105124-48-9

System Generated Number

  • 0105124489

Structure Descriptors

InChI

1S/C13H16FNO/c14-10-5-4-9-2-1-3-12-13(11(9)8-10)16-7-6-15-12/h4-5,8,12-13,15H,1-3,6-7H2/t12-,13-/m0/s1

InChIKey

LCKGQBWTFHRKJB-STQMWFEESA-N

Smiles

c1cc2c(cc1F)[C@H]3[C@H](CCC2)NCCO3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1gm/kg (1000mg/kg)   Farmaco, Edizione Scientifica. Vol. 41, Pg. 229, 1986.