Basic information
- CAS
18283-48-2- Standard SMILES
CCCCCCCCCOC(=O)C[N+](C)(C)CCCCCC[N+](C)(C)CC(=O)OCCCCCCCCC.[Cl-].[Cl-]- InChIKey
GSFRPQVUMJGKCO-UHFFFAOYSA-L- Molecular formula
- C32H66Cl2N2O4
- Average molar mass
- 613.8 g/mol
- Monoisotopic mass
- 612.439964
Names & identifiers
- Preferred name
- Ammonium, hexamethylenebis((carboxymethyl)dimethyl-, dichloride, dinonyl ester
- IUPAC
- 6-[dimethyl-(2-nonoxy-2-oxoethyl)azaniumyl]hexyl-dimethyl-(2-nonoxy-2-oxoethyl)azanium dichloride
Names & synonyms
18283-48-2Hexamethylenebis((carboxymethyl)dimethylammonium), dichloride, dinonyl ester1,6-Hexanediamine, N,N'-dicarboxymethyl-N,N'-dimethyl-, dimethochloride, dinonyl esterAMMONIUM, HEXAMETHYLENEBIS((CARBOXYMETHYL)DIMETHYL-, DICHLORIDE, DINONYL ESTERRefChem:319379DTXSID10939635N~1~,N~1~,N~6~,N~6~-Tetramethyl-N~1~,N~6~-bis[2-(nonyloxy)-2-oxoethyl]hexane-1,6-bis(aminium) dichloride
Database identifiers
- CAS
18283-48-2- PubChem CID
- 29014
- DTXSID
DTXSID10939635
Properties
Computed structural properties
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 29
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 528
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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