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Substance Name: Carbamic acid, isopropyl-, 2-(hydroxymethyl)-2,3-dimethylpentyl ester
RN: 25384-47-8
InChIKey: VBLCEXPSCQTKLT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H25-N-O3

Molecular Weight

  • 231.333
 
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Names and Synonyms

Synonyms

  • BRN 3048585
  • Isopropylcarbamic acid 2-(hydroxymethyl)-2,3-dimethylpentyl ester

Systematic Name

  • Carbamic acid, isopropyl-, 2-(hydroxymethyl)-2,3-dimethylpentyl ester

Registry Numbers

CAS Registry Number

  • 25384-47-8

System Generated Number

  • 0025384478

Structure Descriptors

InChI

1S/C12H25NO3/c1-6-10(4)12(5,7-14)8-16-11(15)13-9(2)3/h9-10,14H,6-8H2,1-5H3,(H,13,15)

InChIKey

VBLCEXPSCQTKLT-UHFFFAOYSA-N

Smiles

C(NC(C)C)(=O)OC[C@@]([C@@H](CC)C)(C)CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 280mg/kg (280mg/kg) AUTONOMIC NERVOUS SYSTEM: "SMOOTH MUSCLE RELAXANT (MECHANISM UNDEFINED, SPASMOLYTIC)" Journal of Medicinal Chemistry. Vol. 12, Pg. 462, 1969.