Ketoprofen sodium supplier | CasNO.57495-14-4

Name
sodium 2-(3-benzoylphenyl)propionate
EINECS
CAS No. 57495-14-4
Density g/cm³
Solubility
Melting Point 184 °C
Formula C16H14 O3 . Na
Boiling Point 431.3°Cat760mmHg
Molecular Weight 276.267
Flash Point 228.8°C
Transport Information
Appearance
Safety Poison by ingestion, subcutaneous, intramuscular, intravenous, and intraperitoneal routes. An experimental teratogen. When heated to decomposition it emits toxic fumes of Na₂O.
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzeneaceticacid, 3-benzoyl-a-methyl-,sodium salt (9CI); 2-(3-Benzoylphenyl)propionic acid sodium salt; Diractin;Ketoprofen sodium; Sodium ketoprofen
PSA 57.20000
LogP 1.77100

Synthetic route

: 22071-15-4
ketoprofen

: 57495-14-4
m-benzoylhydratropic acid sodium salt

Conditions

Conditions	Yield
With sodium hydroxide In water; acetonitrile pH=7 - 8;

: 157617-92-0
N,N-dimethyl-N-benzyl-N-(2-methacryloyloxyethyl)ammonium bromide

: 57495-14-4
m-benzoylhydratropic acid sodium salt

: 1345856-44-1
N,N-dimethyl-N-benzyl-N-(2-methacryloyloxyethyl)ammonium ketoprofenate

Conditions

Conditions	Yield
In chloroform at 20℃; for 2h;	100%

: 1192205-90-5
Br(1-)*C19H24NO2(1+)

: 57495-14-4
m-benzoylhydratropic acid sodium salt

: 1345856-50-9
C16H13O3(1-)*C19H24NO2(1+)

Conditions

Conditions	Yield
In chloroform at 20℃; for 2h;	99%

: 63148-26-5
N,N-dimethyl-N-(hexadecyl)-N-(2-methacryloyloxyethyl)ammonium iodide

: 57495-14-4
m-benzoylhydratropic acid sodium salt

: N,N-dimethyl-N-(hexadecyl)-N-(2-methacryloyloxyethyl)ammonium ketoprofenate

Conditions

Conditions	Yield
In chloroform at 20℃; for 2h;	99%

: 57495-14-4
m-benzoylhydratropic acid sodium salt

pivaloyloxymethyl reagent: pivaloyloxymethyl reagent

: ketoprofen pivaloyloxymethyl ester

Conditions

Conditions	Yield
In N,N-dimethyl-formamide at 60℃; for 24h; Esterification;	96%

: 57495-14-4
m-benzoylhydratropic acid sodium salt

acetoxypropyl reagent: acetoxypropyl reagent

: ketoprofen acetyloxypropyl ester

Conditions

Conditions	Yield
In N,N-dimethyl-formamide at 60℃; for 24h; Esterification;	90%

: 1399258-35-5
tris(2-((4-tert-butylbenzyl)amino)ethyl)amine

: 34946-82-2
copper(II) bis(trifluoromethanesulfonate)

: 57495-14-4
m-benzoylhydratropic acid sodium salt

: 1399258-30-0
Cu(OOCCH(CH3)C6H4COC6H5)(N(CH2CH2NHCH2C6H4C(CH3)3)3)(1+)*OOCCHCH3C6H4COC6H5(1-)=Cu(O2C2CH3C13H10O)2(N(C2H4NHCH2C10H13)3)

Conditions

Conditions	Yield
elem. anal.;	90%

...Expand

: 57495-14-4
m-benzoylhydratropic acid sodium salt

hydroxyethyl reagent: hydroxyethyl reagent

: 70125-82-5
2-(3-benzoylphenyl)propionic acid 2-hydroxyethyl ester

Conditions

Conditions	Yield
In N,N-dimethyl-formamide at 60℃; for 24h; Esterification;	82%

: 57495-14-4
m-benzoylhydratropic acid sodium salt

acetoxybutyl reagent: acetoxybutyl reagent

: ketoprofen acetyloxybutyl ester

Conditions

Conditions	Yield
In N,N-dimethyl-formamide at 60℃; for 24h; Esterification;	82%

: 75-07-0
acetaldehyde

: 57495-14-4
m-benzoylhydratropic acid sodium salt

: [3-(2-hydroxy-1-methyl-propyl)-phenyl]-phenyl-methanone

Conditions

Conditions	Yield
With zeolite NaY In various solvent(s) UV-irradiation;	82%

: 57495-14-4
m-benzoylhydratropic acid sodium salt

acetoxymethyl reagent: acetoxymethyl reagent

: ketoprofen acetyloxymethyl ester

Conditions

Conditions	Yield
In N,N-dimethyl-formamide at 60℃; for 24h; Esterification;	64%

: 57495-14-4
m-benzoylhydratropic acid sodium salt

acetoxyethyl reagent: acetoxyethyl reagent

: ketoprofen acetyloxyethyl ester

Conditions

Conditions	Yield
In N,N-dimethyl-formamide at 60℃; for 24h; Esterification;	49%

: 57495-14-4
m-benzoylhydratropic acid sodium salt

hydroxypropyl reagent: hydroxypropyl reagent

: 214708-31-3
ketoprofen hydroxypropyl ester

Conditions

Conditions	Yield
In N,N-dimethyl-formamide at 60℃; for 24h; Esterification;	48%

: 57495-14-4
m-benzoylhydratropic acid sodium salt

hydroxybutyl reagent: hydroxybutyl reagent

: ketoprofen hydroxybutyl ester

Conditions

Conditions	Yield
In N,N-dimethyl-formamide at 60℃; for 24h; Esterification;	22%

: 57495-14-4
m-benzoylhydratropic acid sodium salt

: 66067-43-4
3-ethylbenzophenone

Conditions

Conditions	Yield
With zeolite NaY In various solvent(s) UV-irradiation;

: 57495-14-4
m-benzoylhydratropic acid sodium salt

: 446311-24-6
4-morpholinecarboxylic acid 2-bromoethyl ester

: m-benzoylhydratropic acid morpholinocarbonyloxyethyl ester

Conditions

Conditions	Yield
In DMF (N,N-dimethyl-formamide) at 60℃; for 20h;

: 1-(4-Amino-3-bromo-5-diethylaminomethyl-benzoyloxy)-3-chloro-n-propane

: 57495-14-4
m-benzoylhydratropic acid sodium salt

: 1-(4-Amino-3-bromo-5-diethylaminomethyl-benzoyloxy)-3-(3-benzoyl-α-methyl-phenylacetoxy)-n-propane

: 1-(4-Amino-3-bromo-5-diethylaminomethyl-benzoyloxy)-4-chloro-n-butane

: 57495-14-4
m-benzoylhydratropic acid sodium salt

: 1-(4-Amino-3-bromo-5-diethylaminomethyl-benzoyloxy)-4-(3-benzoyl-α-methyl-phenylacetoxy)-n-butane

: 7732-18-5
water

: 57495-14-4
m-benzoylhydratropic acid sodium salt

: cerous nitrate

: Ce(ketoprofen(-1H))3*1.5H2O

Conditions

Conditions	Yield
In water soln. of ketoprofen (Na salt) was added slowly with stirring to soln. ofmetal salt; ppt. washed (H2O); filtered; dried on filter paper; kept in desiccator (anhyd. CaCl2); elem. anal.;

...Expand

: 7732-18-5
water

: 10361-82-7
samarium(III) chloride

: 57495-14-4
m-benzoylhydratropic acid sodium salt

: Sm(ketoprofen(-1H))3*0.5H2O

Conditions

Conditions	Yield
In water soln. of ketoprofen (Na salt) was added slowly with stirring to soln. ofmetal salt; ppt. washed (H2O); filtered; dried on filter paper; kept in desiccator (anhyd. CaCl2); elem. anal.;

...Expand

: 7732-18-5
water

: 10025-76-0
europium(III) chloride

: 57495-14-4
m-benzoylhydratropic acid sodium salt

: Eu(ketoprofen(-1H))3*H2O

Conditions

Conditions	Yield
In water soln. of ketoprofen (Na salt) was added slowly with stirring to soln. ofmetal salt; ppt. washed (H2O); filtered; dried on filter paper; kept in desiccator (anhyd. CaCl2); elem. anal.;

...Expand

: 7732-18-5
water

: 10024-93-8
neodymium trichloride

: 57495-14-4
m-benzoylhydratropic acid sodium salt

: Nd(ketoprofen(-1H))3*1.5H2O

Conditions

Conditions	Yield
In water soln. of ketoprofen (Na salt) was added slowly with stirring to soln. ofmetal salt; ppt. washed (H2O); filtered; dried on filter paper; kept in desiccator (anhyd. CaCl2); elem. anal.;

...Expand

: 7732-18-5
water

: 10099-58-8
lanthanum(III) chloride

: 57495-14-4
m-benzoylhydratropic acid sodium salt

: La(ketoprofen(-1H))3*H2O

Conditions

Conditions	Yield
In water soln. of ketoprofen (Na salt) was added slowly with stirring to soln. ofmetal salt; ppt. washed (H2O); filtered; dried on filter paper; kept in desiccator (anhyd. CaCl2); elem. anal.;

...Expand

: 7732-18-5
water

: 10361-79-2
praseodymium(III) chloride

: 57495-14-4
m-benzoylhydratropic acid sodium salt

: Pr(ketoprofen(-1H))3*0.5H2O

Conditions

Conditions	Yield
In water soln. of ketoprofen (Na salt) was added slowly with stirring to soln. ofmetal salt; ppt. washed (H2O); filtered; dried on filter paper; kept in desiccator (anhyd. CaCl2); elem. anal.;

...Expand

Ketoprofen sodium Chemical Properties

IUPAC Name: Sodium 2-(3-benzoylphenyl)propanoate
CAS: 57495-14-4
EINECS: 260-770-0
Following is the Molecular Structure of Ketoprofen sodium (57495-14-4):

SMILES: [Na+].[O-]C(=O)C(c2cc(C(=O)c1ccccc1)ccc2)C
InChI: InChI=1/C16H14O3.Na/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12;/h2-11H,1H3,(H,18,19);/q;+1/p-1
InChIKey: OAPDLBHLMVYMCW-REWHXWOFAE
Std.InChI: InChI=1S/C16H14O3.Na/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12;/h2-11H,1H3,(H,18,19);/q;+1/p-1
Std.InChIKey: OAPDLBHLMVYMCW-UHFFFAOYSA-M
Molecular Formula: C₁₆H₁₃NaO₃
Molecular Weight: 276.26239
Boiling Point: 431.3℃ at 760mmHg
Flash Point: 228.8℃
Enthalpy of Vaporization: 72.41kJ/mol
Vapour Pressure: 3.32E-08mmHg at 25℃

Ketoprofen sodium Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	intramuscular	400mg/kg (400mg/kg)		Pharmaceutical Sciences. Vol. 3, Pg. 203, 1997.
mouse	LD50	intraperitoneal	520mg/kg (520mg/kg)	BEHAVIORAL: COMA LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES	Oyo Yakuri. Pharmacometrics. Vol. 13, Pg. 709, 1977.
mouse	LD50	intravenous	738mg/kg (738mg/kg)	BEHAVIORAL: COMA LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES	Oyo Yakuri. Pharmacometrics. Vol. 13, Pg. 709, 1977.
mouse	LD50	oral	735mg/kg (735mg/kg)	BEHAVIORAL: COMA LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES	Oyo Yakuri. Pharmacometrics. Vol. 13, Pg. 709, 1977.
mouse	LD50	subcutaneous	820mg/kg (820mg/kg)	BEHAVIORAL: COMA LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES	Oyo Yakuri. Pharmacometrics. Vol. 13, Pg. 709, 1977.
rat	LD50	intramuscular	125mg/kg (125mg/kg)	BEHAVIORAL: COMA LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES	Oyo Yakuri. Pharmacometrics. Vol. 13, Pg. 709, 1977.
rat	LD50	intraperitoneal	66mg/kg (66mg/kg)	BEHAVIORAL: COMA LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES	Oyo Yakuri. Pharmacometrics. Vol. 13, Pg. 709, 1977.
rat	LD50	intravenous	343mg/kg (343mg/kg)	BEHAVIORAL: COMA LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES	Oyo Yakuri. Pharmacometrics. Vol. 13, Pg. 709, 1977.
rat	LD50	oral	215mg/kg (215mg/kg)	BEHAVIORAL: COMA LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES	Oyo Yakuri. Pharmacometrics. Vol. 13, Pg. 709, 1977.
rat	LD50	subcutaneous	154mg/kg (154mg/kg)		Jitchuken Zenrinsho Kenkyuho. Central Institute for Experimental Animals, Research Reports. Vol. 1, Pg. 101, 1975.

Ketoprofen sodium Safety Profile

Poison by ingestion, subcutaneous, intramuscular, intravenous, and intraperitoneal routes. It's an experimental teratogen.

Ketoprofen sodium Specification

Ketoprofen sodium (57495-14-4),which also can be called for Sodium 2-(3-benzoylphenyl)propionate ; 19583-RP Sodium ; 19583-RP-Na ; 3-Benzoyl-α-methylbenzeneacetic acid sodium salt ; Ketoprofen sodium ; Sodium ketoprofen .When Ketoprofen sodium (57495-14-4) was heated, it emits toxic fumes of Na₂O .

Product Name

sodium 2-(3-benzoylphenyl)propionate

Synthetic route

Ketoprofen sodium Chemical Properties

Ketoprofen sodium Toxicity Data With Reference

Ketoprofen sodium Safety Profile

Ketoprofen sodium Specification

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