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Substance Name: 1-Isobenzofuranmethanamine, 1,3-dihydro-N,N-dimethyl-3-phenyl-, cis-
RN: 28165-25-5
InChIKey: XHBCRHMJIAQUCP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H19-N-O

Molecular Weight

  • 253.343
 
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Names and Synonyms

Synonyms

  • cis-1,3-Dihydro-N,N-dimethyl-3-phenyl-1-isobenzofuranmethanamine
  • cis-1-(N,N-Dimethylaminomethyl)-3-phenyl-1,3-dihydroisobenzofuran

Systematic Name

  • 1-Isobenzofuranmethanamine, 1,3-dihydro-N,N-dimethyl-3-phenyl-, cis-

Registry Numbers

CAS Registry Number

  • 28165-25-5

System Generated Number

  • 0028165255

Structure Descriptors

InChI

1S/C17H19NO/c1-18(2)12-16-14-10-6-7-11-15(14)17(19-16)13-8-4-3-5-9-13/h3-11,16-17H,12H2,1-2H3

InChIKey

XHBCRHMJIAQUCP-UHFFFAOYSA-N

Smiles

c12[C@@H](c3ccccc3)O[C@@H](CN(C)C)c1cccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 23, Pg. 1261, 1984.