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Substance Name: 2(3H)-Furanone, 5-(3-methylbutyl)-3-(phenylmethylene)-
RN: 120388-31-0
InChIKey: LZMIRPVHPUYHSJ-GXDHUFHOSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H18-O2

Molecular Weight

  • 242.3162
 
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Names and Synonyms

Synonyms

  • 5-(3-Methylbutyl)-3-(phenylmethylene)-2(3H)-furanone
  • 5-Isoamyl-3-benzylidene-3H-furan-2-one
  • BRN 3549153

Systematic Name

  • 2(3H)-Furanone, 5-(3-methylbutyl)-3-(phenylmethylene)-

Registry Numbers

CAS Registry Number

  • 120388-31-0

System Generated Number

  • 0120388310

Structure Descriptors

InChI

1S/C16H18O2/c1-12(2)8-9-15-11-14(16(17)18-15)10-13-6-4-3-5-7-13/h3-7,10-12H,8-9H2,1-2H3/b14-10+

InChIKey

LZMIRPVHPUYHSJ-GXDHUFHOSA-N

Smiles

CC(C)CCC1=C/C(=C\c2ccccc2)/C(=O)O1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 280mg/kg (280mg/kg)   Pharmaceutical Chemistry Journal Vol. 23, Pg. 147, 1989.