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Substance Name: 2(5H)-Furanone, 3-bromo-4,5-dimethyl-5-(1-pyrrolidinylmethyl)-
RN: 104502-48-9
InChIKey: BKHRJLZCGLOQLR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H16-Br-N-O2

Molecular Weight

  • 274.156
 
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Names and Synonyms

Synonyms

  • 3-Bromo-4,5-dimethyl-5-(1-pyrrolidinylmethyl)-2(5H)-furanone
  • BRN 4684762

Systematic Name

  • 2(5H)-Furanone, 3-bromo-4,5-dimethyl-5-(1-pyrrolidinylmethyl)-

Registry Numbers

CAS Registry Number

  • 104502-48-9

System Generated Number

  • 0104502489

Structure Descriptors

InChI

1S/C11H16BrNO2/c1-8-9(12)10(14)15-11(8,2)7-13-5-3-4-6-13/h3-7H2,1-2H3

InChIKey

BKHRJLZCGLOQLR-UHFFFAOYSA-N

Smiles

C([C@@]1(C(=C(Br)C(O1)=O)C)C)N1CCCC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 197mg/kg (197mg/kg) LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)
Pharmaceutical Chemistry Journal Vol. 20, Pg. 737, 1986.