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Substance Name: Carbamic acid, methyl-, 3-hydroxy-2,2-di-p-tolylpropyl ester
RN: 25384-60-5
InChIKey: WNPSVNKFQVAULY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H23-N-O3

Molecular Weight

  • 313.395
 
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Names and Synonyms

Synonyms

  • 3-Hydroxy-2,2-di-p-tolylpropyl methylcarbamate
  • Methylcarbamic acid 3-hydroxy-2,2-di-p-tolylpropyl ester

Systematic Name

  • Carbamic acid, methyl-, 3-hydroxy-2,2-di-p-tolylpropyl ester

Registry Numbers

CAS Registry Number

  • 25384-60-5

System Generated Number

  • 0025384605

Structure Descriptors

InChI

1S/C19H23NO3/c1-14-4-8-16(9-5-14)19(12-21,13-23-18(22)20-3)17-10-6-15(2)7-11-17/h4-11,21H,12-13H2,1-3H3,(H,20,22)

InChIKey

WNPSVNKFQVAULY-UHFFFAOYSA-N

Smiles

C(NC)(=O)OCC(CO)(c1ccc(cc1)C)c1ccc(cc1)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1400mg/kg (1400mg/kg) AUTONOMIC NERVOUS SYSTEM: "SMOOTH MUSCLE RELAXANT (MECHANISM UNDEFINED, SPASMOLYTIC)" Journal of Medicinal Chemistry. Vol. 12, Pg. 462, 1969.