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Substance Name: Verdantiol
RN: 91-51-0
UNII: 3PWS757043
InChIKey: RBAUBIIMPLZNGC-HZHRSRAPSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C22-H27-N-O2

Molecular Weight

  • 337.46
 
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Names and Synonyms

Results Name

  • Verdantiol

Name of Substance

  • Butylphenyl methylpropional methyl anthranilate

Synonyms

  • Benzoic acid, 2-((3-(4-(1,1-dimethylethyl)phenyl)-2-methylpropylidene)amino)-, methyl ester
  • EINECS 202-073-6
  • Lilial-methylanthranilate (Schiff Base)
  • Lilial-methylanthranilate, Schiff's base
  • Methyl-N-(p-tert-butyl-alpha-methylhydrocinnamylidene) anthranilate
  • UNII-3PWS757043
  • Verdantiol

Systematic Names

  • Anthranilic acid, N-(3-(p-tert-butylphenyl)-2-methylpropylidene)-, methyl ester
  • Benzoic acid, 2-((3-(4-(1,1-dimethylethyl)phenyl)-2-methylpropylidene)amino)-, methyl ester
  • Methyl 2-((3-(4-(1,1-dimethylethyl)phenyl)-2-methylpropylidene)amino)benzoate

Registry Numbers

CAS Registry Number

  • 91-51-0

FDA UNII

  • 3PWS757043

System Generated Number

  • 0000091510

Structure Descriptors

InChI

1S/C22H27NO2/c1-16(14-17-10-12-18(13-11-17)22(2,3)4)15-23-20-9-7-6-8-19(20)21(24)25-5/h6-13,15-16H,14H2,1-5H3/b23-15+

InChIKey

RBAUBIIMPLZNGC-HZHRSRAPSA-N

Smiles

c1cc(ccc1C(C)(C)C)C[C@@H](\C=N\c1ccccc1C(=O)OC)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 20, Pg. 729, 1982.
rat LD50 oral 3gm/kg (3000mg/kg)   Food and Chemical Toxicology. Vol. 20, Pg. 729, 1982.