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Substance Name: 3-Isoxazolidinone, 4-((3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)methylene)-2-methyl-, (Z)-
RN: 127245-21-0
InChIKey: OTOTVZIIINPDEE-MDWZMJQESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H27-N-O3

Molecular Weight

  • 317.4263
 
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Names and Synonyms

Synonyms

  • (Z)-4-((3,5-Bis(1,1-dimethylethyl)-4-hydroxyphenyl)methylene)-2-methyl-3-isoxazolidinone
  • (Z)-4-(3,5-Di-tert-butyl-4-hydroxybenzylidene)-2-methyl-3-isoxazolidinone

Systematic Name

  • 3-Isoxazolidinone, 4-((3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)methylene)-2-methyl-, (Z)-

Registry Numbers

CAS Registry Number

  • 127245-21-0

System Generated Number

  • 0127245210

Structure Descriptors

InChI

1S/C19H27NO3/c1-18(2,3)14-9-12(8-13-11-23-20(7)17(13)22)10-15(16(14)21)19(4,5)6/h8-10,21H,11H2,1-7H3/b13-8+

InChIKey

OTOTVZIIINPDEE-MDWZMJQESA-N

Smiles

CC(C)(C)c1cc(cc(c1O)C(C)(C)C)/C=C/2\CON(C2=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4892870,