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Substance Name: Nicotinic acid, 1,2,5,6-tetrahydro-1-methyl-, isopropyl ester
RN: 10558-56-2
InChIKey: UCCRGRWAACBLFP-UHFFFAOYSA-N

Molecular Formula

  • C10-H17-N-O2

Molecular Weight

  • 183.249
 
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Names and Synonyms

Synonyms

  • 5-22-01-00323 (Beilstein Handbook Reference)
  • BRN 0132010
  • i-Propyl 1-methyl-1,2,5,6-tetrahydronicotinate

Systematic Name

  • Nicotinic acid, 1,2,5,6-tetrahydro-1-methyl-, isopropyl ester

Registry Numbers

CAS Registry Number

  • 10558-56-2

System Generated Number

  • 0010558562

Structure Descriptors

InChI

1S/C10H17NO2/c1-8(2)13-10(12)9-5-4-6-11(3)7-9/h5,8H,4,6-7H2,1-3H3

InChIKey

UCCRGRWAACBLFP-UHFFFAOYSA-N

Smiles

C=1(C(OC(C)C)=O)C[N@@](CCC1)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 63mg/kg (63mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#12591,