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Substance Name: 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(7-fluoroheptyl)-3-methyl-1-phenyl-
RN: 102504-79-0
InChIKey: OLCJABOSXQSHFP-UHFFFAOYSA-N

Molecular Formula

  • C21-H32-F-N3-O

Molecular Weight

  • 361.5018
 
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Names and Synonyms

Synonyms

  • 8-(7-Fluoroheptyl)-3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane
  • RTECS YA7518000

Systematic Name

  • 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(7-fluoroheptyl)-3-methyl-1-phenyl-

Registry Numbers

CAS Registry Number

  • 102504-79-0

System Generated Number

  • 0102504790

Structure Descriptors

InChI

1S/C21H32FN3O/c1-23-18-25(19-10-6-5-7-11-19)21(20(23)26)12-16-24(17-13-21)15-9-4-2-3-8-14-22/h5-7,10-11H,2-4,8-9,12-18H2,1H3

InChIKey

OLCJABOSXQSHFP-UHFFFAOYSA-N

Smiles

CN1CN(C2(C1=O)CCN(CC2)CCCCCCCF)c3ccccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 13mg/kg (13mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#11743,