Imidazole, 4-ethyl-5-methyl-, 1,2-ethanedisulfonate (2:1)
Basic information
- CAS
29584-97-2- Standard SMILES
CCc1nc[nH]c1C.CCc1nc[nH]c1C.O=S(=O)(O)CCS(=O)(=O)O- InChIKey
CXPUFTIDYTZMLN-UHFFFAOYSA-N- Molecular formula
- C14H26N4O6S2
- Average molar mass
- 410.5 g/mol
- Monoisotopic mass
- 410.12937691
Names & identifiers
- Preferred name
- Imidazole, 4-ethyl-5-methyl-, 1,2-ethanedisulfonate (2:1)
- IUPAC
- ethane-1,2-disulfonic acid;bis(4-ethyl-5-methyl-1H-imidazole)
- English name
- ethane-1,2-disulfonic acid, 4-ethyl-5-methyl-1H-imidazole
- Molecular formula
- C14H26N4O6S2
- Molecular weight
- 410.50944
Names & synonyms
4-Ethyl-5-methylimidazole 1,2-ethanedisulfonateImidazole, 4-ethyl-5-methyl-, 1,2-ethanedisulfonate (2:1)29584-97-2DTXSID20183768RefChem:348873DTXCID60106259Ethane-1,2-disulfonic acid--4-ethyl-5-methyl-1H-imidazole (1/2)ethane-1,2-disulfonic acid, 4-ethyl-5-methyl-1H-imidazole
Database identifiers
- CAS
29584-97-2- PubChem CID
- 207291
- DTXSID
DTXSID20183768
Properties
Computed structural properties
- Topological polar surface area
- 183 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 312
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…