Products Categories
| CAS No.: | 937-34-8 |
|---|---|
| Name: | phenylsulfate |
| Article Data: | 21 |
| Molecular Structure: | |
|
|
|
| Formula: | C6H6O4S |
| Molecular Weight: | 174.177 |
| Synonyms: | Phenylsulfate (6CI,7CI);Phenol sulfate;Phenyl hydrogen sulfate; |
| Density: | 1.508 g/cm3 |
| PSA: | 71.98000 |
| LogP: | 1.94900 |
- 958254-66-51H-Imidazo[4,5-b]pyridine-2-carboxaldehyde, 1-methyl-, hydrochloride
- 99170-93-1N-Methyl-2-oxazolamine
- 97730-31-9(S)-4'-(2-Methylbutyl)Biphenyl-4-Carbonitrile
- 95789-13-21,3,7-trimethylpurine-2,6-dione
- 956104-42-02-Bromo-5-nitro-3-(trifluoromethyl)pyridine
- 945683-37-41-butyl-2,3-dimethylimidazolium octanesulfate
- 946052-36-41-Butyl-3-methylpyridinium methanesulfonate
- 942196-38-51-Hexyl-3-methylpyridinium hexafluorophosphat
- 943976-22-5Mefway
- 943962-59-2Tosyl-Mefway
- 16475-29-9
phenylchlorosulfate
- 937-34-8
phenol sulfate
| Conditions | Yield |
|---|---|
| With sodium hydroxide |
| Conditions | Yield |
|---|---|
| With 1,4-dioxane; sulfur trioxide; 1,2-dichloro-ethane | |
| Multi-step reaction with 2 steps 1: benzene; SO2Cl2 / 0 °C 2: diluted aqueous NaOH View Scheme |
| Conditions | Yield |
|---|---|
| With carbon disulfide; chlorosulfonic acid at -15℃; |
| Conditions | Yield |
|---|---|
| With chlorosulfonic acid; N,N-dimethyl-aniline at 0℃; | |
| With pyridine; chlorosulfonic acid at 0℃; | |
| With quinoline; chlorosulfonic acid at 0℃; |
- 104733-04-2
2-carboxyphenyl phenyl sulphate
A
- 937-34-8
phenol sulfate
B
- 89-45-2
sulfooxyphenylcarboxylic acid
C
- 69-72-7
salicylic acid
D
- 108-95-2
phenol
| Conditions | Yield |
|---|---|
| With aqueous buffer (pH 8.3) at 60℃; Rate constant; Product distribution; Mechanism; pH-rate profiles; effect of ionic strenght; |
- 108-95-2
phenol
A
- 98-67-9
p-hydoroxybenzenesulfonic acid
B
- 937-34-8
phenol sulfate
C
- 609-46-1
phenol-2-sulfonic acid
| Conditions | Yield |
|---|---|
| With sulfur trioxide In dichloromethane at -20℃; for 1h; Product distribution; Mechanism; different temp., different time; | |
| With sulfur trioxide In dichloromethane at -50℃; for 0.5h; Title compound not separated from byproducts; |
- 108-95-2
phenol
A
- 98-67-9
p-hydoroxybenzenesulfonic acid
B
- 937-34-8
phenol sulfate
C
- 118795-68-9
4-hydroxybenzenesulfonate sulfate
| Conditions | Yield |
|---|---|
| With sulfur trioxide In nitromethane-d3 at -35℃; for 0.25h; Product distribution; various solvents, times, temperatures, amounts of SO3; |
| Conditions | Yield |
|---|---|
| With sulfur trioxide In 1,4-dioxane at 22℃; |
| Conditions | Yield |
|---|---|
| unter Kuehlung; |
- Total:9 Page 1 of 1 1
What can I do for you?
Get Best Price
Specification
The Phenylsulfate is an organic compound with the formula C6H6O4S. The IUPAC name of this chemical is phenyl hydrogen sulfate. With the CAS registry number 937-34-8, it is also named as Sulfuric acid, monophenyl ester. And the molecular weight is 174.17444. The related registry number is 1733-88-6 (potassium salt)
The other characteristics of this product can be summarized as: (1)ACD/LogP: 1.30; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.2; (4)ACD/LogD (pH 7.4): -2.2; (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: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 60.98 Å2; (13)Index of Refraction: 1.587; (14)Molar Refractivity: 38.84 cm3; (15)Molar Volume: 115.4 cm3; (16)Polarizability: 15.39×10-24 cm3; (17)Surface Tension: 62 dyne/cm; (18)Rotatable Bond Count: 2; (19)Exact Mass: 173.998679; (20)MonoIsotopic Mass 173.998679; (21)Topological Polar Surface Area: 72; (22)Heavy Atom Count: 11; (23)Complexity: 197.
People can use the following data to convert to the molecule structure.
1. SMILES:O=S(=O)(Oc1ccccc1)O
2. InChI:InChI=1/C6H6O4S/c7-11(8,9)10-6-4-2-1-3-5-6/h1-5H,(H,7,8,9)
3. InChIKey:CTYRPMDGLDAWRQ-UHFFFAOYAC
4. Std. InChI:InChI=1S/C6H6O4S/c7-11(8,9)10-6-4-2-1-3-5-6/h1-5H,(H,7,8,9)
5. Std. InChIKey:CTYRPMDGLDAWRQ-UHFFFAOYSA-N