13177-41-8
Product Name:
3-(Dimethyloctadecylazaniumyl)propane-1-sulfonate
Formula:
C23H49NO3S
Synonyms:
N-Octadecyl-N,N-dimethyl-3-ammonio-1-propanesulfonate;3-(N,N-Dimethylstearylammonio)propanesulfonate;3-(Stearyl-dimethylammonio)propanesulfonate;SB3-18;Stearyl sulfobetaine
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Beige hygroscopic powder; [Sigma-Aldrich MSDS] |
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Chemical Classes | Nitrogen Compounds -> Quaternary Amines |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
Molecular Weight | 419.7 g/mol |
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XLogP3 | 8.3 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 20 |
Exact Mass | 419.34331560 g/mol |
Monoisotopic Mass | 419.34331560 g/mol |
Topological Polar Surface Area | 65.6 Ų |
Heavy Atom Count | 28 |
Formal Charge | 0 |
Complexity | 416 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |