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Substance Name: 3-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate
RN: 1613-12-3
InChIKey: HDYBHCZQYPXCED-BTJKTKAUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H25-N-O2.C4-H4-O4

Molecular Weight

  • 379.45
 
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Names and Synonyms

Synonyms

  • 3-Oxetanemethanamine, N,N-diethyl-3-((2-methylphenoxy)methyl)-, (Z)-2-butenedioate (1:1)
  • H.C. 6014
  • N,N-Diethyl-3-((o-tolyloxy)methyl)-3-oxetanemethylamine maleate

Systematic Name

  • 3-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate

Registry Numbers

CAS Registry Number

  • 1613-12-3

System Generated Number

  • 0001613123

Molecular Formulas

Molecular Formula

  • C16-H25-N-O2.C4-H4-O4

Molecular Formula Fragments

  • C16-H25-N-O2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C16H25NO2.C4H4O4/c1-4-17(5-2)10-16(11-18-12-16)13-19-15-9-7-6-8-14(15)3;5-3(6)1-2-4(7)8/h6-9H,4-5,10-13H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

InChIKey

HDYBHCZQYPXCED-BTJKTKAUSA-N

Smiles

C1OCC1(COc1ccccc1C)CN(CC)CC.C(=C/C(O)=O)\C(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 44mg/kg (44mg/kg)   Therapie. Vol. 20, Pg. 409, 1965.