Basic information
- Standard SMILES
CCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CCO.O=[N+]([O-])[O-]- InChIKey
HNWNELAGDBSCDG-UHFFFAOYSA-O- Molecular formula
- C25H53N2O2.NO3
- Average molar mass
- 475.7 g/mol
- Monoisotopic mass
- 475.3985218
Names & identifiers
- Preferred name
- (2-Hydroxyethyl)dimethyl(3-((1-oxooctadecyl)amino)propyl)ammonium nitrate
- IUPAC
- 2-hydroxyethyl-dimethyl-[3-(octadecanoylamino)propyl]azanium nitrate
- English name
- 2-hydroxyethyldimethyl-3-stearamidopropylammonium nitrate
- Molecular formula
- C25H53N3O5
- Molecular weight
- 475.72
Names & synonyms
Show more names
Database identifiers
- CAS
2764-13-8- PubChem CID
- 62463
- DTXSID
DTXSID0062632- EC Number
- 220-432-5
Properties
Computed structural properties
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 22
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 377
Experimental & physicochemical properties
Physicochemical properties
- EPA Substance Registry System
- 2 · 2-Hydroxyethyl dimethyl 3-stearamidopropyl ammonium nitrate (2764-13-8)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- TSCA
- TSCA listed
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (99.3%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P273, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 144 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: 1-Propanaminium, N-(2-hydroxyethyl)-N,N-dimethyl-3-[(1-oxooctadecyl)amino]-, nitrate (salt)
1-Propanaminium, N-(2-hydroxyethyl)-N,N-dimethyl-3-[(1-oxooctadecyl)amino]-, nitrate (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Propanaminium, N-(2-hydroxyethyl)-N,N-dimethyl-3-[(1-oxooctadecyl)amino]-, nitrate (1:1) are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
(2-hydroxyethyl)dimethyl[3-[(1-oxooctadecyl)amino]propyl]ammonium nitrate: Does not have an individual approval but may be used under an appropriate group standard
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Uses & manufacturing
General Manufacturing Information
Plastics Material and Resin Manufacturing
1-Propanaminium, N-(2-hydroxyethyl)-N,N-dimethyl-3-[(1-oxooctadecyl)amino]-, nitrate (1:1): ACTIVE
Suppliers7 total
Related reactions
No reaction records under the current filter.
Linked notes
Loading…