Molecular Identity
482-54-2
2-[[2-[bis(carboxymethyl)amino]cyclohexyl]-(carboxymethyl)amino]acetic acid
PubChem CID: 10213
Cyclohexane-1,2-diaminetetraacetic acid is an organooxygen compound. It is functionally related to a tetracarboxylic acid.
2D Structure
Properties
C14H22N2O8
Molecular Formula
346.33
Molecular Weight
g/mol
346.1376
Exact Mass
Da
-4.5
XLogP
Drug-like (Lipinski: < 5)
156
TPSA
May have limited oral absorption
4
H-Bond Donors
10
H-Bond Acceptors
419
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
482-54-2CyDTAOCTAKomplexon IVGlycine, N,N'-1,2-cyclohexanediylbis[N-(carboxymethyl)-Cyclohexanediamine tetraacetic acido-Cyclohexanediaminetetraacetic acidCHEL 6001,2-Cyclohexanediaminetetraacetic acid1,2-Diaminocyclohexanetetraacetic acid1,2-Cyclohexylenediaminetetraacetic acid1,2-Diaminocyclohexane-N,N,N',N'-tetraacetic acidDTXSID80862002Glycine, N,N'-1,2-cyclohexanediylbis(N-(carboxymethyl)-RefChem:1052219
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to 482-54-2
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