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| CAS No.: | 16836-95-6 |
|---|---|
| Name: | SILVER P-TOLUENESULFONATE |
| Article Data: | 12 |
| Molecular Structure: | |
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|
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| Formula: | C7H8AgO3S |
| Molecular Weight: | 279.065 |
| Synonyms: | p-Toluenesulfonic acid, silver(1+) salt(8CI);Silver 4-methylbenzenesulfonate;Silver p-methylbenzenesulfonate;Silver p-tolylsulfonate;Silver p-tosylate;Silver(1+) 4-methylbenzenesulfonate;Silver(1+) 4-toluenesulfonate; |
| EINECS: | 240-859-0 |
| Density: | 1.34g/cm3 |
| Melting Point: | 106-107ºC |
| Solubility: | Soluble in water. |
| Appearance: | White to light grey crystalline powder |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 36/37/38 |
| Safety: | 26-36 |
| PSA: | 65.58000 |
| LogP: | 1.97990 |
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Specification
The IUPAC name of Benzenesulfonic acid,4-methyl-, silver(1+) salt (1:1) is silver 4-methylbenzenesulfonate. With the CAS registry number 16836-95-6, it is also named as p-Toluenesulfonic acid, silver(1+) salt. The other registry number is 30918-75-3. It is white to light grey crystalline powder which is stable but sensitive to light. Additioanlly, this chemical should be should be sealed in the container and stored in the ventilate and dry place.
The other characteristics of this product can be summarized as: (1)ACD/LogP: 0.93; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.57; (4)ACD/LogD (pH 7.4): -2.57; (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: 1; (11)#Freely Rotating Bonds: 1; (12)Exact Mass: 277.916683; (13)MonoIsotopic Mass: 277.916683; (14)Topological Polar Surface Area: 65.6; (15)Heavy Atom Count: 12; (16)Complexity: 193 .
Uses of Benzenesulfonic acid,4-methyl-, silver(1+) salt (1:1): It can react with Dimethyl-bis(trimethylsilyl)bromethyl-bromsilan to get Brom[dimethyl(p-tolylsulfonyloxy)silyl]bis(trimethylsilyl)methan. This reaction needs solvent tetrahydrofuran.
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When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. If you want to contact this product, you must wear suitable protective clothing.
People can use the following data to convert to the molecule structure.
1. SMILES:[Ag+].O=S([O-])(=O)c1ccc(cc1)C
2. InChI:InChI=1/C7H8O3S.Ag/c1-6-2-4-7(5-3-6)11(8,9)10;/h2-5H,1H3,(H,8,9,10);/q;+1/p-1
3. InChIKey:JUDUFOKGIZUSFP-REWHXWOFAH