Basic information
- CAS
17100-11-7- Standard SMILES
O=C([O-])CN(CCN(CC(=O)[O-])CC(=O)O)CC(=O)[O-].[Al+3]- InChIKey
UIWKFQZCUQWNRP-UHFFFAOYSA-K- Molecular formula
- C10H13AlN2O8
- Average molar mass
- 316.2 g/mol
- Monoisotopic mass
- 316.0487288
Names & identifiers
- Preferred name
- Aluminate(1-), ((N,N'-1,2-ethanediylbis(N-((carboxy-kappaO)methyl)glycinato-kappaN,kappaO))(4-))-, hydrogen (1:1), (OC-6-21)-
- IUPAC
- aluminum 2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxymethyl)amino]acetate
Names & synonyms
17100-11-7DTXSID30168985RefChem:1076585DTXCID1091476Aluminate(1-), ((N,N'-1,2-ethanediylbis(N-((carboxy-kappaO)methyl)glycinato-kappaN,kappaO))(4-))-, hydrogen (1:1), (OC-6-21)-Aluminum ethylenediamine tetraacetateUIWKFQZCUQWNRP-UHFFFAOYSA-KAluminium 2,2'-({2-[(carboxylatomethyl)(carboxymethyl)amino]ethyl}azanediyl)diacetate
Database identifiers
- CAS
17100-11-7- PubChem CID
- 28284
- DTXSID
DTXSID30168985- Nikkaji
- J136.002G
Properties
Computed structural properties
- Topological polar surface area
- 164 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 351
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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