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Substance Name: 2-Propanol, 1-(6-isopropyl-m-tolyloxy)-3-(2-propynyloxy)-, carbamate
RN: 16222-49-4
InChIKey: NUNDVWLZTMCSSM-UHFFFAOYSA-N

Molecular Formula

  • C17-H23-N-O4

Molecular Weight

  • 305.372
 
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Names and Synonyms

Synonyms

  • 1-(2-Propynyloxy)-2-carbamoyl glycerol 3-(6-isopropyl-m-tolyl) ether
  • 1-(6-Isopropyl-m-tolyloxy)-3-(2-propynyloxy)-2-propanol carbamate
  • BRN 2474587

Systematic Name

  • 2-Propanol, 1-(6-isopropyl-m-tolyloxy)-3-(2-propynyloxy)-, carbamate

Registry Numbers

CAS Registry Number

  • 16222-49-4

System Generated Number

  • 0016222494

Structure Descriptors

InChI

1S/C17H23NO4/c1-5-8-20-10-14(22-17(18)19)11-21-16-9-13(4)6-7-15(16)12(2)3/h1,6-7,9,12,14H,8,10-11H2,2-4H3,(H2,18,19)

InChIKey

NUNDVWLZTMCSSM-UHFFFAOYSA-N

Smiles

C([C@@H](COc1cc(C)ccc1C(C)C)OC(N)=O)OCC#C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 3gm/kg (3000mg/kg)   Chimica Therapeutica. Vol. 4, Pg. 474, 1969.