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Substance Name: p-Cresol, alpha-(alpha,alpha-dimethylphenethylamino)-3-methoxy-, maleate
RN: 68397-90-0
InChIKey: NGLXIXSGVRXUFQ-BTJKTKAUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H23-N-O2.C4-H4-O4

Molecular Weight

  • 401.456
 
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Names and Synonyms

Synonyms

  • alpha-(alpha,alpha-Dimethylphenethylamino)-3-methoxy-p-cresol maleate
  • F 1693
  • Phenol, 4-(((1,1-dimethyl-2-phenylethyl)amino)methyl)-2-methoxy-, (Z)-2-butenedioate (1:1)

Systematic Name

  • p-Cresol, alpha-(alpha,alpha-dimethylphenethylamino)-3-methoxy-, maleate

Registry Numbers

CAS Registry Number

  • 68397-90-0

System Generated Number

  • 0068397900

Molecular Formulas

Molecular Formula

  • C18-H23-N-O2.C4-H4-O4

Molecular Formula Fragments

  • C18-H23-N-O2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C18H23NO2.C4H4O4/c1-18(2,12-14-7-5-4-6-8-14)19-13-15-9-10-16(20)11-17(15)21-3;5-3(6)1-2-4(7)8/h4-11,19-20H,12-13H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

InChIKey

NGLXIXSGVRXUFQ-BTJKTKAUSA-N

Smiles

c1(c(cc(cc1)O)OC)C[NH2+]C(C)(C)Cc1ccccc1.C(=C/C(=O)[O-])\C(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral 300mg/kg (300mg/kg)   Bollettino Chimico Farmaceutico. Vol. 117, Pg. 83, 1978.