Morpholinium, 4,4'-(4,4'-biphenylene)bis(2-oxoethylene)bis(4-ethyl-, dibromide
Basic information
- CAS
78186-42-2- Standard SMILES
CC[N+]1(CC(=O)c2ccc(-c3ccc(C(=O)C[N+]4(CC)CCOCC4)cc3)cc2)CCOCC1.[Br-].[Br-]- InChIKey
JWTRBDKLNYEGBO-UHFFFAOYSA-L- Molecular formula
- C28H38Br2N2O4
- Average molar mass
- 626.4 g/mol
- Monoisotopic mass
- 624.11983
Names & identifiers
- Preferred name
- Morpholinium, 4,4'-(4,4'-biphenylene)bis(2-oxoethylene)bis(4-ethyl-, dibromide
- IUPAC
- 2-(4-ethylmorpholin-4-ium-4-yl)-1-[4-[4-[2-(4-ethylmorpholin-4-ium-4-yl)acetyl]phenyl]phenyl]ethanone dibromide
- English name
- 4,4'-(4,4'-Biphenylene)bis(2-oxoethylene)bis(4-ethylmorpholinium) dibromide
- Molecular formula
- C28H38N2O4.2Br
- Molecular weight
- 626.426
Names & synonyms
4,4'-(4,4'-Biphenylene)bis(2-oxoethylene)bis(4-ethylmorpholinium) dibromide78186-42-2Morpholinium, 4,4'-(4,4'-biphenylene)bis(2-oxoethylene)bis(4-ethyl-, dibromideRefChem:357883DTXSID809994234,4'-[[1,1'-Biphenyl]-4,4'-diylbis(2-oxoethane-2,1-diyl)]bis(4-ethylmorpholin-4-ium) dibromide
Database identifiers
- CAS
78186-42-2- PubChem CID
- 3060486
- DTXSID
DTXSID80999423
Properties
Computed structural properties
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 610
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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