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Substance Name: Carbamic acid, sec-butyl-, 2-(hydroxymethyl)-2-methylpentyl ester
RN: 25384-32-1
InChIKey: HKTXFTWRXBMFPB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H25-N2-O3

Molecular Weight

  • 231.3335
 
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Names and Synonyms

Synonym

  • sec-Butylcarbamic acid 2-(hydroxymethyl)-2-methylpentyl ester

Systematic Name

  • Carbamic acid, sec-butyl-, 2-(hydroxymethyl)-2-methylpentyl ester

Registry Numbers

CAS Registry Number

  • 25384-32-1

System Generated Number

  • 0025384321

Structure Descriptors

InChI

1S/C12H25NO3/c1-5-7-12(4,8-14)9-16-11(15)13-10(3)6-2/h10,14H,5-9H2,1-4H3,(H,13,15)

InChIKey

HKTXFTWRXBMFPB-UHFFFAOYSA-N

Smiles

CCCC(C)(CO)COC(=O)NC(C)CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 420mg/kg (420mg/kg) AUTONOMIC NERVOUS SYSTEM: "SMOOTH MUSCLE RELAXANT (MECHANISM UNDEFINED, SPASMOLYTIC)" Journal of Medicinal Chemistry. Vol. 12, Pg. 462, 1969.