Products 105394-74-9

CAS 105394-74-9 appears in our catalog under these names: Isothiocyanobenzyl EDTA, ~90% (HPLC), 1-(4-Isothiocyanatobenzyl)ethylenediamin. Offered by: Chemat, Sigma-Aldrich. Available pack sizes: 10mg.

Isothiocyanobenzyl EDTA, ~90% (HPLC)
Chemat
  • size: 10mg
  • Variants: 1
from 11829.20
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1-(4-Isothiocyanatobenzyl)ethylenediamin
Sigma-Aldrich
  • size: 10MG
  • Variants: 1
from 4010.00
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Structural formula: {0} (CAS {1})

2-[[2-[bis(carboxymethyl)amino]-3-(4-isothiocyanatophenyl)propyl]-(carboxymethyl)amino]acetic acid (CAS 105394-74-9) is a chemical compound with the molecular formula C18H21N3O8S and a molecular weight of 439.4 g/mol. IUPAC name: 2-[[2-[bis(carboxymethyl)amino]-3-(4-isothiocyanatophenyl)propyl]-(carboxymethyl)amino]acetic acid. InChIKey: VHMWJVAFPCGUTJ-UHFFFAOYSA-N.

Identity
Molecular formulaC18H21N3O8S
Molecular weight439.4 g/mol
IUPAC name2-[[2-[bis(carboxymethyl)amino]-3-(4-isothiocyanatophenyl)propyl]-(carboxymethyl)amino]acetic acid
InChIKeyVHMWJVAFPCGUTJ-UHFFFAOYSA-N
SMILESC1=CC(=CC=C1CC(CN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O)N=C=S

Computed by PubChem (NCBI)

Synonyms: 1-(4-Isothiocyanatobenzyl)ethylenediamine-N,N,N',N'-tetraacetic acid, Isothiocyanobenzyl EDTA, 1-(4-Isothiocyanatobenzyl)ethylenediamine-n,n,n,n-tetraaceticacid, 1-(p-isothiocyanatobenzyl)ethylenediaminetetraacetic acid, 1-(p-isothiocyanatobenzyl) ethylenediaminetetra acetic acid