Product Name

  • Name

    N,N-diethyl-N-methyl-3-[(methylcarbamoyl)oxy]anilinium iodide

  • EINECS
  • CAS No. 60398-22-3
  • Article Data2
  • CAS DataBase
  • Density
  • Solubility
  • Melting Point
  • Formula C13H21N2O2•I
  • Boiling Point
  • Molecular Weight 364.226
  • Flash Point
  • Transport Information
  • Appearance
  • Safety A deadly poison by ingestion, intravenous, and subcutaneous routes. When heated to decomposition it emits very toxic fumes of NOx, NH3, and I−. See also ESTERS and CARBAMATES.
  • Risk Codes
  • Molecular Structure Molecular Structure of 60398-22-3 (N,N-diethyl-N-methyl-3-[(methylcarbamoyl)oxy]anilinium iodide)
  • Hazard Symbols
  • Synonyms
  • PSA
  • LogP

Methylcarbamic ester of oxyphenylmethyldiethylammonium iodide Chemical Properties

IUPAC Name: Diethyl-Methyl-[3-(methylcarbamoyloxy)phenyl]azanium iodide 
Following is the structure of Methylcarbamic ester of oxyphenylmethyldiethylammonium iodide (CAS NO.60398-22-3):
              
Empirical Formula: C13H21IN2O2
Molecular Weight: 364.2225 g/mol
Canonical SMILES: CC[N+](C)(CC)C1=CC(=CC=C1)OC(=O)NC.[I-]
InChI: InChI=1S/C13H20N2O2.HI/c1-5-15(4,6-2)11-8-7-9-12(10-11)17-13(16)14-3;/h7-10H,5-6H2,1-4H3;1H
InChIKey: XYPQGNNSAIEXIS-UHFFFAOYSA-N

Methylcarbamic ester of oxyphenylmethyldiethylammonium iodide Toxicity Data With Reference

1.    

scu-rat LD50:400 µg/kg

     NTIS**    National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) No. PB158-508 .
2.    

orl-mus LDLo:20 mg/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 43 (1931),413.
3.    

scu-mus LD50:129 µg/kg

     NTIS**    National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) No. PB158-508 .
4.    

ivn-mus LDLo:100 µg/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 43 (1931),413.
5.    

scu-dog LD50:75 µg/kg

     NTIS**    National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) No. PB158-508 .
6.    

scu-mky LD50:200 µg/kg

     NTIS**    National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) No. PB158-508 .
7.    

scu-cat LD50:75 µg/kg

     NTIS**    National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) No. PB158-508 .
8.    

scu-rbt LD50:150 µg/kg

     NTIS**    National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) No. PB158-508 .

Methylcarbamic ester of oxyphenylmethyldiethylammonium iodide Safety Profile

A deadly poison by ingestion, intravenous, and subcutaneous routes. When heated to decomposition, Methylcarbamic ester of oxyphenylmethyldiethylammonium iodide (CAS NO.60398-22-3) emits very toxic fumes of NOx, NH3, and I−. See also ESTERS and CARBAMATES.

Methylcarbamic ester of oxyphenylmethyldiethylammonium iodide Specification

 Methylcarbamic ester of oxyphenylmethyldiethylammonium iodide , its cas register number is 60398-22-3. It also can be called 3-(N'-Methylcarbamoyloxy)-N-methyl-N-diethylanilinium iodide ; 3-Diethylaminophenyl-N-methylcarbamate methiodide ; Ammonium, (3-(N-methylcarbamoyloxy)phenyl)diethylmethyl-, iodide ; Benzenaminium, N,N-diethyl-N-methyl-3-(((methylamino)carbonyl)oxy)-, iodide ; Carbamic acid, N-methyl-, 3-(diethylmethylammonio)phenyl ester, iodide ; Carbamic acid, N-methyl-, 3-diethylaminophenyl ester, methiodide ; Methiodide of N-methylurethane of 3-diethylaminophenol ; 3-Diethylaminophenyl-N-methylcarbamate methiodide ; and TL 1217 . Its classification code is Drug / Therapeutic Agent.

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