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Substance Name: Cryptand 2.2
RN: 23978-55-4
UNII: XLY51T1RSZ
InChIKey: NLMDJJTUQPXZFG-UHFFFAOYSA-N

Note

  • A macrocyclic diaza-crown ether.

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H26-N2-O4

Molecular Weight

  • 262.347
 
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Names and Synonyms

Name of Substance

  • Cryptand 2.2

Synonyms

  • 1,7,10,16-Tetraoxa-4,13-diazacyclooctadecane
  • 7,16-Diaza-1,4,10,13-tetraoxcyclooctadecane
  • 7,16-Diaza-18-crown-6
  • Cryptand 22
  • Diaza-18-crown-6
  • EINECS 245-965-0
  • Kryptofix 22
  • NSC 339325
  • UNII-XLY51T1RSZ

Systematic Names

  • 1,10-Diaza-4,7,13,16-tetraoxacyclooctadecane
  • 1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane

Registry Numbers

CAS Registry Number

  • 23978-55-4

FDA UNII

  • XLY51T1RSZ

Other Registry Number

  • 97760-34-4

System Generated Number

  • 0023978554

Structure Descriptors

InChI

1S/C12H26N2O4/c1-5-15-9-10-17-7-3-14-4-8-18-12-11-16-6-2-13-1/h13-14H,1-12H2

InChIKey

NLMDJJTUQPXZFG-UHFFFAOYSA-N

Smiles

N1CCOCCOCCNCCOCCOCC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 141mg/kg (141mg/kg)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 31(2), Pg. 48, 1987.
mouse LD50 oral 560mg/kg (560mg/kg)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 31(2), Pg. 48, 1987.
rabbit LD50 intraperitoneal 112mg/kg (112mg/kg)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 31(2), Pg. 48, 1987.
rat LD50 intraperitoneal 141mg/kg (141mg/kg)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 31(2), Pg. 48, 1987.
rat LD50 oral 3400mg/kg (3400mg/kg)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 31(2), Pg. 48, 1987.