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Substance Name: N-Nitrosodiethanolamine diacetate
RN: 13256-19-4
InChIKey: KBGJEXGMSFHMPC-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • Tumor Data

Molecular Formula

  • C8-H14-N2-O5

Molecular Weight

  • 218.208
 
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Names and Synonyms

Name of Substance

  • N-Nitrosodiethanolamine diacetate

Synonyms

  • Acetic acid, ester with N-nitroso-2,2'-iminodiethanol
  • Bis-(acetoxyaethyl)nitrosamin
  • Bis-(acetoxyaethyl)nitrosamin [German]
  • BRN 2373587
  • N-Nitroso-2,2'-iminodiethanol diacetate
  • N-Nitrosobis(acetoxyethyl)amine
  • N-Nitrosodiethanolamine diacetate

Systematic Names

  • 2,2'-(Nitrosoimino)bisethanol diacetate (ester)
  • Ethanol, N-nitroso-2,2'-iminodi-, diacetate

Registry Numbers

CAS Registry Number

  • 13256-19-4

System Generated Number

  • 0013256194

Structure Descriptors

InChI

1S/C8H14N2O5/c1-7(11)14-5-3-10(9-13)4-6-15-8(2)12/h3-6H2,1-2H3

InChIKey

KBGJEXGMSFHMPC-UHFFFAOYSA-N

Smiles

N(CCOC(C)=O)(CCOC(C)=O)N=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 5gm/kg (5000mg/kg)   Zeitschrift fuer Krebsforschung. Vol. 69, Pg. 103, 1967.