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Sulfacetamide sodium anhydrous

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Name

Sulfacetamide sodium anhydrous

EINECS 204-848-4
CAS No. 127-56-0 Density N/A
PSA 88.85000 LogP 1.93230
Solubility Soluble in water Melting Point 257 °C
Formula C8H9N2NaO3S Boiling Point 450.8 °C at 760 mmHg
Molecular Weight 236.227 Flash Point 226.4 °C
Transport Information UN 3249 Appearance White crystalline powder
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 127-56-0 (Sulfacetamide sodium) Hazard Symbols IrritantXi
Synonyms

Sulfacetamide sodium;N-Acetylsulfanilamide Sodium Salt Hydrate;N-Acetyl-4-aminobenzenesulfonamide Sodium Salt Hydrate;SulfacetaMide SodiuM Salt Hydrate;sodium,acetyl-(4-aminophenyl)sulfonylazanide;

 

Sulfacetamide sodium anhydrous Synthetic route

123-03-5

cetylpyridinium chloride

127-56-0

sodium 4-aminobenzenesulfonylacetamide

934544-27-1

hexadecylpyridinium sulfacetamide

Conditions
ConditionsYield
In water for 0.5h; Heating / reflux;99.22%
41167-60-6

4-(4-fluorophenyl)-4-oxo-2-hydroxy-2-butenoic acid methyl ester

127-56-0

sodium 4-aminobenzenesulfonylacetamide

900325-79-3

2-hydroxy-4-oxo-4-(4-fluorophenyl)-2-butenoic acid N-(4-(acetylaminosulfonyl)phenyl)amide

Conditions
ConditionsYield
With acetic acid Reflux;95%
541-41-3

chloroformic acid ethyl ester

127-56-0

sodium 4-aminobenzenesulfonylacetamide

81865-29-4

C11H14N2O5S

Conditions
ConditionsYield
Ambient temperature;91.5%
127-56-0

sodium 4-aminobenzenesulfonylacetamide

105-39-5

chloroacetic acid ethyl ester

81865-32-9

N-Sulfanilyl-N-carbethoxymethylacetamine

Conditions
ConditionsYield
In ethanol for 4h; Ambient temperature;89.7%

2-(4-fluorophenyl)-3-(4-fluorophenyl)-5-phenyl-2H-tetrazolium chloride

127-56-0

sodium 4-aminobenzenesulfonylacetamide

C19H13F2N4(1+)*C8H9N2O3S(1-)

Conditions
ConditionsYield
In methanol; water at 20℃; for 2h;88%
127-56-0

sodium 4-aminobenzenesulfonylacetamide

2390-68-3

N,N-didecyl-N,N-dimethylammonium bromide

934544-26-0

didecyldimethylammonium sulfacetamide

Conditions
ConditionsYield
In water for 0.5h;87.74%
127-56-0

sodium 4-aminobenzenesulfonylacetamide

96-34-4

methyl chloroacetate

81865-31-8

[Acetyl-(4-amino-benzenesulfonyl)-amino]-acetic acid methyl ester

Conditions
ConditionsYield
Ambient temperature;87.5%
127-56-0

sodium 4-aminobenzenesulfonylacetamide

79-22-1

methyl chloroformate

81865-28-3

C10H12N2O5S

Conditions
ConditionsYield
Ambient temperature;85.8%
127-56-0

sodium 4-aminobenzenesulfonylacetamide

5018-38-2

4,6-dichloro-5-methoxypyrimidine

5018-23-5

4-(p-aminobenzenesulfonamido)-5-methoxy-6-chloropyrimidine

Conditions
ConditionsYield
In N,N-dimethyl-formamide at 88 - 90℃; for 3h;85.3%
934063-39-5

C11H8Cl2O4

127-56-0

sodium 4-aminobenzenesulfonylacetamide

1610537-08-0

2-hydroxy-4-(2,4-dichlorophenyl)-4-oxo-2-butenoic acid N-(4-acetylaminosulfonylphenyl)amide

Conditions
ConditionsYield
With acetic acid Reflux;83%

Sulfacetamide sodium anhydrous Consensus Reports

Reported in EPA TSCA Inventory.

Sulfacetamide sodium anhydrous Specification

The Sulfacetamide sodium anhydrous, with the CAS registry number 127-56-0,is also known as Sodium sulfacetamide; N-Sulfanilylacetamide monosodium salt; N-(4-Aminophenylsulfonyl)acetamide sodium salt. It belongs to the product categories of Antibiotics for Research and Experimental Use;Biochemistry.Its EINECS number is 204-848-4. This chemical's molecular formula is C8H9N2NaO3S and molecular weight is 236.22. What's more,Its systematic name is Sulfacetamide sodium.It is an anti-infective agent that is used topically to treat skin infections and orally for urinary tract infections. The Sulfacetamide sodium is irritating to eyes, respiratory system and skin.In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.When you use it,you should wear suitable protective clothing.

Physical properties about Sulfacetamide sodium anhydrous are:
(1)ACD/LogP:  -0.964; (2)# of Rule of 5 Violations:  0; (3)ACD/LogD (pH 5.5):  -1.18; (4)ACD/LogD (pH 7.4):  -2.51; (5)ACD/BCF (pH 5.5):  1.00; (6)ACD/BCF (pH 7.4):  1.00; (7)ACD/KOC (pH 5.5):  4.29; (8)ACD/KOC (pH 7.4):  1.00; (9)#H bond acceptors:  5; (10)#H bond donors:  3; (11)#Freely Rotating Bonds:  2; (12)Flash Point:  226.4 °C; (13)Enthalpy of Vaporization:  74.79 kJ/mol ; (14)Boiling Point:  450.8 °C at 760 mmHg; (15)Vapour Pressure:  6.51E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES:[Na+].O=S(=O)([N-]C(=O)C)c1ccc(N)cc1;
(2)Std. InChI:InChI=1S/C8H10N2O3S.Na/c1-6(11)10-14(12,13)8-4-2-7(9)3-5-8;/h2-5H,9H2,1H3,(H,10,11);/q;+1/p-1;
(3)Std. InChIKey:PQMSFAORUFMASU-UHFFFAOYSA-M.

The toxicity data of Sulfacetamide sodium anhydrous as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 6gm/kg (6000mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 9, Pg. 286, 1959.
mouse LDLo intravenous 800mg/kg (800mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 77, Pg. 127, 1943.

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