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| CAS No.: | 6891-44-7 |
|---|---|
| Name: | [2-(Methacryloyloxy)ethyl]trimethylammonium methyl sulfate |
| Article Data: | 4 |
| Molecular Structure: | |
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|
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| Formula: | C10H21NO6S |
| Molecular Weight: | 283.34 |
| Synonyms: | N, N, N-Trimethyl-2-[(2-methylacryloyl)oxy]ethanaminium methyl sulfate; |
| EINECS: | 229-995-1 |
| Density: | 1.183 g/cm3 |
| Boiling Point: | 170℃ at 98.3kPa |
| Appearance: | clear colorless solution |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 38 |
| Safety: | 26-36 |
| PSA: | 101.11000 |
| LogP: | 0.98570 |
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Specification
The [2-(Methacryloyloxy)ethyl]trimethylammonium methyl sulfate, with the CAS registry number 6891-44-7, is also known as N, N, N-Trimethyl-2-[(2-methylacryloyl)oxy]ethanaminium methyl sulfate. It belongs to the product categories of Acrylic Monomers; Methacrylate; Monomers. Its EINECS registry number is 229-995-1. This chemical's molecular formula is C10H21NO6S and molecular weight is 283.34. What's more, its IUPAC name is Methyl sulfate; trimethyl-[2-(2-methylprop-2-enoyloxy)ethyl]azanium. Besides, it should be stored at 0-6 °C.
Physical properties about [2-(Methacryloyloxy)ethyl]trimethylammonium methyl sulfate are: (1)ACD/LogP: -3.08; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.08; (4)ACD/LogD (pH 7.4): -3.08; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 26.3 Å2.
When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to skin. In addition, this chemical may cause inflammation to the skin or other mucous membranes. During using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OCC[N+](C)(C)C)\C(=C)C.[O-]S(=O)(=O)OC
(2) InChI: InChI=1/C9H18NO2.CH4O4S/c1-8(2)9(11)12-7-6-10(3,4)5;1-5-6(2,3)4/h1,6-7H2,2-5H3;1H3,(H,2,3,4)/q+1;/p-1
(3) InChIKey: IHBKAGRPNRKYAO-REWHXWOFAH