Registration Dossier
Registration Dossier
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EC number: 416-530-4 | CAS number: 178949-82-1
Reference substances
- IUPAC name:
- trisodium 2-({2-[(1-carboxy-2-carboxylatoethyl)amino]ethyl}amino)butanedioate
Inventory
- EC number:
- 416-530-4
- EC name:
- -
- CAS number:
- -
- Description:
- OCTAQUEST E100 IDENTIFIER
- CAS number:
- 178949-82-1
Synonyms
- Names:
- Identifier:
- IUPAC name
- L-Aspartic acid, N,N'-1,2-ethanediylbis-, sodium salt
- Identifier:
- other: SMILES notation
- C(CNC(CC(=O)[O-])C(=O)[O-])N[C@@H](CC(=O)[O-])C(=O)O.[Na+].[Na+].[Na+]
- Identifier:
- other: Molecular formula
- C10H13N2O8.3Na
- Identifier:
- other: synonym
- N,N′-Ethylenedi-(aspartic acid) trisodium salt
- l-aspartic acid, N,N'-1,2-ethanediylbis-, trisodium salt
Molecular and structural information
- Molecular formula:
- C10H13N2Na3O8
- Molecular weight:
- ca. 358.19
- SMILES notation:
- OC(CC(C(O)=O)NCCNC(C(O)=O)CC(O)=O)=OC
- InChl:
- C(CNC(CC(=O)[O-])C(=O)[O-])NC(CC(=O)O)C(=O)[O-].[Na+].[Na+].[Na+]
- Structural formula:
Related substances
Information on Registered Substances comes from registration dossiers which have been assigned a registration number. The assignment of a registration number does however not guarantee that the information in the dossier is correct or that the dossier is compliant with Regulation (EC) No 1907/2006 (the REACH Regulation). This information has not been reviewed or verified by the Agency or any other authority. The content is subject to change without prior notice.
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