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Substance Name: 1H-Imidazole-1-ethanamine, 2-(8-heptadecen-1-yl)-4,5-dihydro-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
RN: 68083-45-4
InChIKey: TXNMYADEYJLEJS-RRABGKBLSA-N

Molecular Formula

  • C22-H43-N3.C6-H8-O7

Molecular Weight

  • 541.725
 
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Names and Synonyms

Synonyms

  • 1-(2-Aminoethyl)-2-(8-heptadecenyl)-2-imidazoline, monocitrate
  • EINECS 268-394-9

Systematic Names

  • 1H-Imidazole-1-ethanamine, 2-(8-heptadecen-1-yl)-4,5-dihydro-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
  • 1H-Imidazole-1-ethanamine, 2-(8-heptadecenyl)-4,5-dihydro-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
  • 2-Heptadec-8-enyl-4,5-dihydro-1H-imidazole-1-ethylamine monocitrate

Registry Numbers

CAS Registry Number

  • 68083-45-4

System Generated Number

  • 0068083454

Molecular Formulas

Molecular Formula

  • C22-H43-N3.C6-H8-O7

Molecular Formula Fragments

  • C22-H43-N3
  • C6-H8-O7
  • COMPONENT

Structure Descriptors

InChI

1S/C22H43N3.C6H8O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-24-19-21-25(22)20-18-23;7-3(8)1-6(13,5(11)12)2-4(9)10/h9-10H,2-8,11-21,23H2,1H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/b10-9+;

InChIKey

TXNMYADEYJLEJS-RRABGKBLSA-N

Smiles

C(C(CC(=O)O)(C(=O)O)O)C(=O)O.N1=C(CCCCCCC\C=C\CCCCCCCC)N(CCN)CC1