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Substance Name: Triethylenetetraminehexaacetic acid
RN: 869-52-3
InChIKey: RAEOEMDZDMCHJA-UHFFFAOYSA-N

Classification Codes

  • Chelating Agents
  • Sequestering Agents

Molecular Formulas

  • C18-H30-N4-O12
  • C6-H18-N4.6C2-H4-O2

Molecular Weight

  • 494.451
 
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Names and Synonyms

Name of Substance

  • Triethylenetetraminehexaacetic acid

Synonyms

  • 3,6,9,12-Tetraazatetradecanedioic acid, 3,6,9,12-tetrakis(carboxymethyl)-
  • EINECS 212-790-6
  • Triethylenetetramine-N,N,N',N',N'',N''-hexaacetic acid
  • Triethylenetetraminehexaacetate
  • TTHA

Systematic Names

  • 3,6,9,12-Tetraazatetradecanedioic acid, 3,6,9,12-tetrakis(carboxymethyl)-
  • 3,6,9,12-Tetrakis(carboxymethyl)-3,6,9,12-tetraazatetradecanedioicacid
  • Acetic acid, compd. with triethylenetetramine (6:1)

Registry Numbers

CAS Registry Number

  • 869-52-3

Other Registry Number

  • 20261-67-0

System Generated Number

  • 0000869523

Molecular Formulas

Molecular Formulas

  • C18-H30-N4-O12
  • C6-H18-N4.6C2-H4-O2

Molecular Formula Fragments

  • C2-H4-O2
  • C6-H18-N4
  • COMPONENT

Structure Descriptors

InChI

1S/C18H30N4O12/c23-13(24)7-19(3-5-21(9-15(27)28)10-16(29)30)1-2-20(8-14(25)26)4-6-22(11-17(31)32)12-18(33)34/h1-12H2,(H,23,24)(H,25,26)(H,27,28)(H,29,30)(H,31,32)(H,33,34)

InChIKey

RAEOEMDZDMCHJA-UHFFFAOYSA-N

Smiles

O=C(O)C[N@@](CC[N@@](CCN(CC(=O)O)CC(=O)O)CC(=O)O)CCN(CC(=O)O)CC(=O)O