trans-1,2-Diaminocyclohexane-N,N,N',N'-tetraacetic acid monohydrate

Base Information

• Chemical Name: trans-1,2-Diaminocyclohexane-N,N,N',N'-tetraacetic acid monohydrate
• CAS No.: 125572-95-4
• Molecular Formula: C14H22N2O8.H2O
• Molecular Weight: 364.35
• Hs Code.: 2922 49 85
• European Community (EC) Number: 681-197-6
• UNII: V3971SG9LH
• DSSTox Substance ID: DTXSID20369106
• Wikidata: Q27291483
• Mol file: 125572-95-4.mol

Synonyms:125572-95-4;trans-1,2-Diaminocyclohexane-N,N,N',N'-tetraacetic acid monohydrate;2,2',2'',2'''-(trans-Cyclohexane-1,2-diylbis(azanetriyl))tetraacetic acid hydrate;DCTA (monohydrate);2,2',2'',2'''-((1R,2R)-rel-Cyclohexane-1,2-diylbis(azanetriyl))tetraacetic acid hydrate;V3971SG9LH;2-[[(1R,2R)-2-[bis(carboxymethyl)amino]cyclohexyl]-(carboxymethyl)amino]acetic acid;hydrate;1,2-Cyclohexanedinitrilotetraacetic acid;Glycine, N,N'-(1R,2R)-1,2-cyclohexanediylbis[N-(carboxymethyl)-, hydrate (1:1), rel-;dcyta;Cyclohexane-1,2-diamine-N,N,N',N'-tetraacetic acid monohydrate, trans-;Glycine, N,N'-(1R,2R)-1,2-cyclohexanediylbis(N-(carboxymethyl)-, hydrate (1:1), rel-;Glycine, N,N'-(1R,2R)-1,2-cyclohexanediylbis(N-(carboxymethyl)-, monohydrate, rel-;Glycine, N,N'-1,2-cyclohexanediylbis(N-(carboxymethyl)-, monohydrate, trans-(+/-)-;Rel-N,N'-(1R,2R)-1,2-cyclohexanediylbis(N-(carboxymethyl)glycine hydrate (1:1);MFCD00149243;trans-1,2-cyclohexanediaminetetraacetic acid monohydrate;C14H24N2O9;2-[[(1R,2R)-2-[bis(carboxymethyl)amino]cyclohexyl]-(carboxymethyl)amino]acetic acid,hydrate;UNII-V3971SG9LH;SCHEMBL303864;DTXSID20369106;AKOS015903582;CS-W013894;HY-W013178;DS-15383;(1, 2-Cyclohexylenedinitrilo)-tetraacetic Acid;O10553;J-005247;Q27291483;trans-1,2-diaminocyclohexane-n,n,n,n-tetraacetic acid;trans-1,2-cyclohexane diamine tetraacetic acid monohydrate;trans-cyclohexane-1,2-diamine-N,N,N',N'-tetraacetic acid monohydrate;2,2'',2'''',2''''''-(trans-Cyclohexane-1,2-diylbis(azanetriyl))tetraacetic acid hydrate;2,2',2'',2'''-(trans-Cyclohexane-1,2-diyl-bis(azanetriyl))tetraacetic acid hydrate;2,2',2'',2'''-(trans-Cyclohexane-1,2-diylbis(azanetriyl))tetraaceticacidhydrate;2,2',2'',2'''-[(1R,2R)-Cyclohexane-1,2-diyldinitrilo]tetraacetic acid--water (1/1);trans-1,2-Diaminocyclohexane-N,N,N',N'-tetraacetic acid monohydrate, >=99% (titration);trans-1,2-Diaminocyclohexane-N,N,N',N'-tetraacetic acid monohydrate, p.a., 99%;trans-1,2-Diaminocyclohexane-N,N,N',N'-tetraacetic acid monohydrate, ACS reagent, 97.5-100.5%

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Chemical Property of trans-1,2-Diaminocyclohexane-N,N,N',N'-tetraacetic acid monohydrate

Chemical Property:

• Appearance/Colour: white fine crystalline powder
• Melting Point: 213-216 ºC(lit.)
• Boiling Point: 670.8 °C at 760 mmHg
• Flash Point: 359.5 °C
• PSA: 164.91000
• LogP: -0.82430
• Storage Temp.: Store below +30°C.
• Water Solubility.: Slightly soluble in water. Soluble in 1N sodium hydroxide and alkali solutions. Insoluble in most common organic solvents.
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 10
• Exact Mass: 364.14818035
• Heavy Atom Count: 25
• Complexity: 419

Purity/Quality:

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1CCC(C(C1)N(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O.O
• Isomeric SMILES: C1CC[C@H]([C@@H](C1)N(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O.O
• Uses: trans-1,2-Diaminocyclohexane-N,N,N',N'-tetraacetic acid monohydrate is an analytical reagent and a complexating agent for sodium. It acts as a ligand to prepare lanthanide shift reagents. It is involved in the separation and determination of iron(III)-dimethyldithiocarbamate, manganese(II)-ethylenebisdithiocarbamate and zinc(II)-ethylenebisdithiocarbamate by sensitive capillary electrophoretic ultraviolet method. trans-1,2-Diaminocyclohexane-N,N,N′,N′-tetraacetic acid monohydrate is a multidentate ligand{1-6} that may be used as a chelating agent in the preparation of metal-chelate complexes.