Dimethyldioctadecylammonium methyl sulfate
Completing data — refresh the page later to see the latest
Basic information
- CAS
3843-16-1- Standard SMILES
CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCCCC.COS(=O)(=O)[O-]- InChIKey
FPDLLPXYRWELCU-UHFFFAOYSA-M- Molecular formula
- C38H80N.CH3O4S
- Average molar mass
- 662.1 g/mol
- Monoisotopic mass
- 661.60428114
Names & identifiers
- Preferred name
- Dimethyldioctadecylammonium methyl sulfate
- IUPAC
- dimethyl(dioctadecyl)azanium;methyl sulfate
- English name
- N,N-DIMETHYL-N,N-DISTEARYLAMMONIUM METHOSULFATE
- Molecular formula
- C39H83NO4S
- Molecular weight
- 662.15
Names & synonyms
Dimethyldioctadecylammonium methyl sulfateDimethyldi(octadecyl)ammonium methyl sulfateRefChem:767403843-16-11-Octadecanaminium, N,N-dimethyl-N-octadecyl-, methyl sulfateDimethyldi(octadecyl)ammonium methyl sulphaten,n-dimethyl-n-octadecyloctadecan-1-aminium methyl sulfateSCHEMBL61318DTXSID3063209EINECS 223-336-1distearyl dimethyl ammonium methylsulfatedistearyl dimethyl ammonium methyl sulfate
Show more names
DISTEARYLDIMETHYLAMMONIUM METHOSULFATEN,N-DIMETHYL-N,N-DISTEARYLAMMONIUM METHOSULFATEn,n-dimethyl-n-octadecyl-1-octadecanaminiu methyl sulfate1-Octadecanaminium, N, N-dimethyl-N-octadecyl-, methyl sulfate
NS000811951-Octadecanaminium, N,N-dimethyl-N-octadecyl-, methyl sulfate (1:1)
Database identifiers
- CAS
3843-16-1- PubChem CID
- 77450
- DTXSID
DTXSID3063209- EC Number
- 223-336-1
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 74.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 34
- Heavy atoms
- 45
- Formal charge
- 0
- Complexity
- 481
Experimental & physicochemical properties
Chemical ClassesNitrogen Compounds -> Amines, Aliphatic
Physicochemical properties
- CAS DataBase Reference
- 3843 · 3843-16-1
- EPA Substance Registry System
- 1 · 1-Octadecanaminium, N,N-dimethyl-N-octadecyl-, methyl sulfate (3843-16-1)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P
- 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.
GHS classification
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Regulatory InformationChemical: 1-Octadecanaminium, N,N-dimethyl-N-octadecyl-, methyl sulfate
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
Substances that augment, stimulate, activate, potentiate, or modulate the immune response at either the cellular or humoral level. The classical agents (Freund's adjuvant, BCG, Corynebacterium parvum, et al.) contain bacterial antigens. Some are endogenous (e.g., histamine, interferon, transfer factor, tuftsin, interleukin-1). Their mode of action is either non-specific, resulting in increased immune responsiveness to a wide variety of antigens, or antigen-specific, i.e., affecting a restricted type of immune response to a narrow group of antigens. The therapeutic efficacy of many biological response modifiers is related to their antigen-specific immunoadjuvanticity.
Substances that prevent infectious agents or organisms from spreading or kill infectious agents in order to prevent the spread of infection.
Agents that modify interfacial tension of water; usually substances that have one lipophilic and one hydrophilic group in the molecule; includes soaps, detergents, emulsifiers, dispersing and wetting agents, and several groups of antiseptics.
Uses & manufacturing
General Manufacturing Information1-Octadecanaminium, N,N-dimethyl-N-octadecyl-, methyl sulfate (1:1): ACTIVE
Related reactions
5 records
Compound notes
Loading…