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acetic acid, (ethylenedinitrilo)tetra-, aluminum sodium salt

HCID 34603
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
29507-62-8
Standard SMILES
O=C([O-])CN(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[Al+3].[Na+]
InChIKey
WSDQQPWXNFSOTK-UHFFFAOYSA-J
Molecular formula
C10H12AlN2NaO8
Average molar mass
338.18 g/mol
Monoisotopic mass
338.030673

Names & identifiers

Preferred name
acetic acid, (ethylenedinitrilo)tetra-, aluminum sodium salt
IUPAC
aluminum;sodium;2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate
English name
AluMinate(1-), [[N,N'-1,2-ethanediylbis[N-(carboxyMethyl)glycinato]](4-)-N,N',O,O',ON,ON']-, sodiuM, (OC-6-21)- (9CI)
Molecular formula
C10H12AlN2NaO8
Molecular weight
338.182188

Names & synonyms

NSC 310149ACETIC ACID, (ETHYLENEDINITRILO)TETRA-, ALUMINUM SODIUM SALTEthylenediaminetetraacetic acid, aluminum sodium salt(Ethylenedinitrilo)tetraacetic acid aluminum sodium salt29507-62-8DTXSID00183706Aluminate(1-), ((N,N'-1,2-ethanediylbis(N-(carboxymethyl)glycinato))(4-)-N,N',O,O',ON,ON')-, sodium, (OC-6-21)-RefChem:316316DTXCID00106197Ethylenediaminetetraacetic acid, aluminum-sodium saltAluminate(1-), ((N,N'-1,2-ethanediylbis(N-(carboxymethyl)glycinato))(4-)-N,N',O,O',ON,ON')-, sodium, (OC-6-21)-(9CI)Ethylenediaminetetraacetic acid, aluminum - sodium salt
Show more names
AluMinate(1-), [[N,N'-1,2-ethanediylbis[N-(carboxyMethyl)glycinato]](4-)-N,N',O,O',ON,ON']-, sodiuM, (OC-6-21)- (9CI)
WSDQQPWXNFSOTK-UHFFFAOYSA-JAluminium sodium 2,2',2'',2'''-(ethane-1,2-diyldinitrilo)tetraacetate (1/1/1)

Properties

Computed structural properties

Topological polar surface area
167 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
10
Rotatable bonds
7
Heavy atoms
22
Formal charge
0
Complexity
293

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes

Database identifiers

CAS
29507-62-8
PubChem CID
34603
DTXSID
DTXSID00183706