1-Dodecanaminium, N,N,N-trimethyl-, 1-methylethyl sulfate (1:1)
Basic information
- CAS
78480-16-7- Standard SMILES
CC(C)OS(=O)(=O)[O-].CCCCCCCCCCCC[N+](C)(C)C- InChIKey
YUCIFAZCIIGUBF-UHFFFAOYSA-M- Molecular formula
- C18H41NO4S
- Average molar mass
- 367.6 g/mol
- Monoisotopic mass
- 367.27562996
Names & identifiers
- Preferred name
- 1-Dodecanaminium, N,N,N-trimethyl-, 1-methylethyl sulfate (1:1)
- IUPAC
- dodecyl(trimethyl)azanium;propan-2-yl sulfate
- English name
- dodecyltrimethylammonium isopropyl sulphate
- Molecular formula
- C18H41NO4S
- Molecular weight
- 367.58744
Names & synonyms
78480-16-7Dodecyltrimethylammonium, isopropyl sulfateEINECS 278-921-41-Dodecanaminium, N,N,N-trimethyl-, 1-methylethyl sulfateDTXSID608885431-Dodecanaminium, N,N,N-trimethyl-, 1-methylethyl sulfate (1:1)RefChem:75632DTXCID701027820Dodecyltrimethylammonium isopropyl sulphateYUCIFAZCIIGUBF-UHFFFAOYSA-MNS00089818N,N,N-trimethyldodecan-1-aminium propan-2-yl sulfate
Database identifiers
- CAS
78480-16-7- PubChem CID
- 174137
- DTXSID
DTXSID60888543- EC Number
- 278-921-4
Properties
Computed structural properties
- Topological polar surface area
- 74.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 12
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 261
Physicochemical properties
- EPA Substance Registry System
- 1 · 1-Dodecanaminium, N,N,N-trimethyl-, 1-methylethyl sulfate (78480-16-7)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1-Dodecanaminium, N,N,N-trimethyl-, 1-methylethyl sulfate (1:1): ACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…