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Substance Name: Dibenz(b,f)oxepin-2-acetic acid, 10,11-dihydro-alpha-methyl-11-oxo-, (2-hydroxyethoxy)ethyl ester, (+-)-
RN: 72619-41-1
InChIKey: AQVIMIDPDJTEOW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H22-O6

Molecular Weight

  • 370.3988
 
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Names and Synonyms

Synonym

  • 2-(2-Hydroxyethoxy)ethyl dl-2-(10,11-dihydro-11-oxodibenz(b,f)oxepin-2-yl)propionate

Systematic Name

  • Dibenz(b,f)oxepin-2-acetic acid, 10,11-dihydro-alpha-methyl-11-oxo-, (2-hydroxyethoxy)ethyl ester, (+-)-

Registry Numbers

CAS Registry Number

  • 72619-41-1

System Generated Number

  • 0072619411

Structure Descriptors

InChI

1S/C21H22O6/c1-14(21(24)26-11-10-25-9-8-22)15-6-7-20-17(12-15)18(23)13-16-4-2-3-5-19(16)27-20/h2-7,12,14,22H,8-11,13H2,1H3

InChIKey

AQVIMIDPDJTEOW-UHFFFAOYSA-N

Smiles

CC(c1ccc2c(c1)C(=O)Cc3ccccc3O2)C(=O)OCCOCCO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 260mg/kg (260mg/kg)   European Patent Application. Vol. #0003893,