1H-Imidazolium, 1-[2-(carboxymethoxy)ethyl]-1-(carboxymethyl)-4,5-dihydro-2-propyl-, hydroxide, sodium salt (1:1:2)
Basic information
- CAS
69868-15-1- Standard SMILES
CCCC1=NCC[N+]1(CCOCC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[OH-]- InChIKey
HKFYPGSRJDPVPO-UHFFFAOYSA-L- Molecular formula
- C12H20N2Na2O6
- Average molar mass
- 334.28 g/mol
- Monoisotopic mass
- 334.11167493
Names & identifiers
- Preferred name
- 1H-Imidazolium, 1-[2-(carboxymethoxy)ethyl]-1-(carboxymethyl)-4,5-dihydro-2-propyl-, hydroxide, sodium salt (1:1:2)
- IUPAC
- disodium;2-[1-[2-(carboxylatomethoxy)ethyl]-2-propyl-4,5-dihydroimidazol-1-ium-1-yl]acetate;hydroxide
Names & synonyms
EINECS 274-174-369868-15-11H-Imidazolium, 1-(2-(carboxymethoxy)ethyl)-1-(carboxymethyl)-4,5-dihydro-2-propyl-, hydroxide, disodium salt1H-Imidazolium, 1-(2-(carboxymethoxy)ethyl)-1-(carboxymethyl)-4,5-dihydro-2-propyl-, hydroxide, sodium salt (1:1:2)1H-Imidazolium, 1-[2-(carboxymethoxy)ethyl]-1-(carboxymethyl)-4,5-dihydro-2-propyl-, hydroxide, disodium salt1H-Imidazolium, 1-[2-(carboxymethoxy)ethyl]-1-(carboxymethyl)-4,5-dihydro-2-propyl-, hydroxide, sodium salt (1:1:2)RefChem:438463DTXSID70990141HKFYPGSRJDPVPO-UHFFFAOYSA-LNS00061515Disodium 1-(2-(carboxylatomethoxy)ethyl)-1-(carboxylatomethyl)-4,5-dihydro-2-propyl-1H-imidazolium hydroxideSodium hydroxide {1-[2-(carboxylatomethoxy)ethyl]-2-propyl-4,5-dihydro-1H-imidazol-1-ium-1-yl}acetate (2/1/1)
Database identifiers
- CAS
69868-15-1- PubChem CID
- 112335
- DTXSID
DTXSID70990141- EC Number
- 274-174-3
Properties
Computed structural properties
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 358
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1H-Imidazolium, 1-[2-(carboxymethoxy)ethyl]-1-(carboxymethyl)-4,5-dihydro-2-propyl-, hydroxide, sodium salt (1:1:2): INACTIVE
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Compound notes
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