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Substance Name: 2-Propenoic acid, 2-methyl-3-phenyl-, 1,2-dimethyl-1,2-ethanediyl ester
RN: 84006-60-0
InChIKey: LMLNTJBRBYQSOB-YTEMWHBBSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H26-O4

Molecular Weight

  • 378.4654
 
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Names and Synonyms

Synonym

  • 1,2-Dimethyl-1,2-ethanediyl 2-methyl-3-phenyl-2-propenoate

Systematic Name

  • 2-Propenoic acid, 2-methyl-3-phenyl-, 1,2-dimethyl-1,2-ethanediyl ester

Registry Numbers

CAS Registry Number

  • 84006-60-0

System Generated Number

  • 0084006600

Structure Descriptors

InChI

1S/C24H26O4/c1-17(15-21-11-7-5-8-12-21)23(25)27-19(3)20(4)28-24(26)18(2)16-22-13-9-6-10-14-22/h5-16,19-20H,1-4H3/b17-15+,18-16+

InChIKey

LMLNTJBRBYQSOB-YTEMWHBBSA-N

Smiles

CC(OC(=O)/C(=C/c1ccccc1)/C)C(OC(=O)/C(=C/c2ccccc2)/C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   European Patent Application. Vol. #0056189,