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Substance Name: Benzoic acid, (2-cyclohexylamino-1,1-dimethyl)ethyl ester, hydrochloride
RN: 67032-56-8
InChIKey: SOSABIGBQLZZMC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H25-N-O2.Cl-H

Molecular Weight

  • 311.85
 
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Names and Synonyms

  • Benzoic acid, (2-cyclohexylamino-1,1-dimethyl)ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 67032-56-8

System Generated Number

  • 0067032568

Molecular Formulas

Molecular Formula

  • C17-H25-N-O2.Cl-H

Molecular Formula Fragments

  • C17-H25-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H25NO2.ClH/c1-17(2,13-18-15-11-7-4-8-12-15)20-16(19)14-9-5-3-6-10-14;/h3,5-6,9-10,15,18H,4,7-8,11-13H2,1-2H3;1H

InChIKey

SOSABIGBQLZZMC-UHFFFAOYSA-N

Smiles

c1(C(OC(C[NH2+]C2CCCCC2)(C)C)=O)ccccc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 200mg/kg (200mg/kg)   Journal of the American Chemical Society. Vol. 66, Pg. 1738, 1944.