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Substance Name: 1'-Acetoxyestragole
RN: 61691-82-5
InChIKey: VGSCGPYUCPWRQY-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • Tumor Data

Molecular Formula

  • C12-H14-O3

Molecular Weight

  • 206.24
 
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Names and Synonyms

Name of Substance

  • 1'-Acetoxyestragole

Synonyms

  • 1'-Acetoxyestragole
  • alpha-Ethenyl-4-methoxybenzenemethanol acetate
  • BRN 3050741
  • p-Methoxy-alpha-vinylbenzyl alcohol acetate (ester)

Systematic Names

  • Benzenemethanol, alpha-ethenyl-4-methoxy-, acetate (9CI)
  • Benzyl alcohol, p-methoxy-alpha-vinyl-, acetate (ester)

Registry Numbers

CAS Registry Number

  • 61691-82-5

System Generated Number

  • 0061691825

Structure Descriptors

InChI

1S/C12H14O3/c1-4-12(15-9(2)13)10-5-7-11(14-3)8-6-10/h4-8,12H,1H2,2-3H3

InChIKey

VGSCGPYUCPWRQY-UHFFFAOYSA-N

Smiles

c1([C@@H](OC(C)=O)C=C)ccc(OC)cc1