Benzeneacetic acid,3-benzoyl-a-methyl-, (aR)- supplier

Name
(2R)-2-(3-benzoylphenyl)propanoic acid
EINECS
CAS No. 56105-81-8
Article Data38
CAS DataBase
Density 1.198g/cm³
Solubility
Melting Point 77-78 °C
Formula C₁₆H₁₄O₃
Boiling Point 431.316 °C at 760 mmHg
Molecular Weight 254.285
Flash Point 228.793 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzeneaceticacid, 3-benzoyl-a-methyl-,(R)-;(-)-2-(3-Benzoylphenyl)propionic acid;(-)-3-Benzoyl-a-methylbenzeneacetic acid;(-)-Ketoprofen;(2R)-2-(3-Benzoylphenyl)propionic acid;(R)-(-)-Ketoprofen;(R)-2-(3-Benzoylphenyl)propionic acid;(R)-3-Benzoyl-a-methylphenylacetic acid;(R)-Ketoprofen;(R)-Ketoprophen;
PSA 54.37000
LogP 3.10570

Synthetic route

: C16H14O3*C17H21NO2

: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
With hydrogenchloride In water at 10 - 35℃;	98%

: 855519-35-6
(RS)-ketoprofen vinyl ester

A: 911412-01-6
(S)-ketoprofen vinyl ester

B: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
With immobilized Lipozyme In 1,4-dioxane; water at 25℃; for 96h; Enzymatic reaction; optical yield given as %ee;	A 90% B n/a

: 156994-73-9
(R)-2-(3-Benzoyl-phenyl)-propionic acid (R)-4,4-dimethyl-2-oxo-tetrahydro-furan-3-yl ester

: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
With sodium carbonate In methanol; water for 2h; Ambient temperature;	85%

: 1019853-52-1
(3R)-1-phenyl-4,4-dimethyl-2-oxopyrrolidin-3-yl (αR)-2-(3-benzoylphenyl)propionate

: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
With hydrogenchloride; acetic acid In water at 120℃; for 2.5h; optical yield given as %ee;	63%

: 22161-82-6
(+)-α-(3-benzylphenyl)propionic acid

A: 22161-81-5
S-ketoprofen

B: 66067-44-5
(3-acetylphenyl)(phenyl)methanone

C: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
With sodium hydroxide; potassium permanganate In water for 6h; Ambient temperature; Yield given;	A n/a B 28.4% C n/a

...Expand

: 57872-48-7, 81601-91-4, 81601-93-6, 47087-07-0
ketoprofen methyl ester

A: 22161-81-5
S-ketoprofen

B: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
With sodium hydroxide In water at 40℃; for 7.55h; titrisol buffer pH 8, carboxylesterase NP; Yield given. Yields of byproduct given. Title compound not separated from byproducts;
With tris hydrochloride; S. solfataricus esterase In water at 60℃; for 32h; pH=7.0; Enzymatic reaction;

: 22071-15-4
ketoprofen

A: 22161-81-5
S-ketoprofen

B: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
With phosphate buffer; sodium dodecyl-sulfate; vancomycin at 20℃; Product distribution; electrophoretic enantioseparations, various substrates;
EtOH, TAPS/Tris buffer, pH 7.7;
lipase from Candida rugosa In 2,2,4-trimethylpentane; acetone Product distribution / selectivity; Resolution of racemate;

: 74614-67-8
α-(3-benzoylphenyl)acrylic acid

A: 22161-81-5
S-ketoprofen

B: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
With (-)-Diop; chloro(1,5-hexadiene)rhodium(I) dimer; hydrogen; triethylamine; benzene In ethanol under 53200 Torr; for 20h; Ambient temperature; Yield given. Title compound not separated from byproducts;
With (-)-Diop; chloro(1,5-hexadiene)rhodium(I) dimer; hydrogen; triethylamine In ethanol; benzene under 11172 - 77140 Torr; Product distribution; different solvents, without NEt3, with KOH; other object: optical yield;

: 114315-58-1
2-chloroethyl ester of 2-(3-benzoylphenyl)propionic acid

A: 22161-81-5
S-ketoprofen

B: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
With water at 40℃; for 40h; Candida rugosa lipase, pH 5; Yield given. Yields of byproduct given. Title compound not separated from byproducts;
With Candida rugosa lipase (Lipase OF); Tween-80 In water at 30℃; for 24h; pH=2.5; Title compound not separated from byproducts;

: (R) ketoprofen glucuronide

A: 6556-12-3, 489-91-8, 528-16-5, 552-12-5, 577-46-8, 643-33-4, 2240-07-5, 6294-16-2, 10133-02-5, 18402-78-3, 18968-14-4, 21179-08-8, 23018-83-9, 33599-45-0, 33599-46-1, 46171-67-9, 46171-69-1, 46172-26-3, 70021-34-0, 71031-08-8, 104195-06-4, 106499-29-0, 124817-72-7
D-glucuronic acid

B: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
With human serum albumin In water at 37℃; pH=7.4; Enzyme kinetics; Further Variations:; Reagents; Hydrolysis; Enzymatic reaction; isotonic 0.067 M phosphate buffer;

: 59512-44-6, 71381-92-5, 109718-56-1
ketoprofen chloride

A: 22161-81-5
S-ketoprofen

B: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
Stage #1: ketoprofen chloride With (S)-(3-OH-4,4-di-Me-2-oxopyrrolidin-1-yl)CH2COOH on resin; triethylamine In tetrahydrofuran at 0℃; Stage #2: With lithium hydroxide In tetrahydrofuran; water at 20℃; for 4h; Further stages. Title compound not separated from byproducts.;

: 362470-63-1
(S)-2-(3-Benzoyl-phenyl)-propionic acid (S)-1-carbamoylmethyl-4,4-dimethyl-2-oxo-pyrrolidin-3-yl ester

A: 22161-81-5
S-ketoprofen

B: 56105-81-8
R-ketoprofen

C: (S)-(3-hydroxy-4,4-dimethyl-2-oxopyrrolidin-1-yl)acetamide

Conditions

Conditions	Yield
With lithium hydroxide In tetrahydrofuran; water at 20℃; for 1h;

...Expand

: 136656-96-7
(R)-(-)-2-(3-benzoylphenyl)propionic acid ethyl ester

: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
With novozyme 435 In water; acetonitrile at 45℃; for 45h;	360 mg

: 22071-15-4
ketoprofen

: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: Novozyme 435 / toluene / 2 h / 45 °C 2: 360 mg / Novozyme 435 / acetonitrile; H2O / 45 h / 45 °C View Scheme
Multi-step reaction with 3 steps 1.1: oxalyl chloride / 12 h / 40 °C 2.1: rink amide linker modified polystyrene grafted crowns; piperidine; benzotriazolyloxy-tris(dimethylamino)phosphonium(1+) PF6(1-) / diisopropylethylamine / dimethylformamide / 12 h / 20 °C 2.2: triethylamine / tetrahydrofuran / 12 h / 0 °C 2.3: 104 mg / trifluoroacetic acid / CH2Cl2 / 0.67 h 3.1: LiOH / tetrahydrofuran; H2O / 1 h / 20 °C View Scheme
Multi-step reaction with 2 steps 1.1: oxalyl chloride / 12 h / 40 °C 2.1: triethylamine; (S)-(3-OH-4,4-di-Me-2-oxopyrrolidin-1-yl)CH2COOH on resin / tetrahydrofuran / 0 °C 2.2: LiOH*H2O / tetrahydrofuran; H2O / 4 h / 20 °C View Scheme

: 59512-44-6, 71381-92-5, 109718-56-1
ketoprofen chloride

: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1.1: rink amide linker modified polystyrene grafted crowns; piperidine; benzotriazolyloxy-tris(dimethylamino)phosphonium(1+) PF6(1-) / diisopropylethylamine / dimethylformamide / 12 h / 20 °C 1.2: triethylamine / tetrahydrofuran / 12 h / 0 °C 1.3: 104 mg / trifluoroacetic acid / CH2Cl2 / 0.67 h 2.1: LiOH / tetrahydrofuran; H2O / 1 h / 20 °C View Scheme
Multi-step reaction with 2 steps 1: 99.5 percent Spectr. / Et3N / toluene / -10 °C 2: 85 percent / Na2CO3 / methanol; H2O / 2 h / Ambient temperature View Scheme

: 75116-78-8
ethyl α-(3-benzoylphenyl)acrylate

: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: 93 percent / 3percent KOH/H2O / tetrahydrofuran / 24 h / Ambient temperature 2: H2, 2/(-)-DIOP/NEt3 / ethanol; benzene / 11172 - 77140 Torr / different solvents, without NEt3, with KOH; other object: optical yield View Scheme

: 22071-15-4
ketoprofen

: 62784-66-1
bis(1-naphthyl)methanol

A: 1116086-47-5
(R)-ketoprofen di(1-naphthyl)methyl ester

B: (S)-ketoprofen di(1-naphthyl)methyl ester

C: 22161-81-5
S-ketoprofen

D: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
With (R)-(+)-2-phenyl-2,3-dihydrobenzo[d]imidazo[2,1-b]thiazole; p-Methoxybenzoic anhydride; N-ethyl-N,N-diisopropylamine In dichloromethane at 20℃; for 12h; Resolution of racemate; optical yield given as %ee;
With (-)-(S)-β-Np-BTM; 2,2-dimethylpropanoic anhydride; N-ethyl-N,N-diisopropylamine In dichloromethane at 20℃; for 12h; Inert atmosphere; Resolution of racemate; optical yield given as %ee; enantioselective reaction;
With benzoic acid anhydride; N-ethyl-N,N-diisopropylamine; (R)-(+)-2-phenyl-2,3-dihydrobenzo[d]imidazo[2,1-b]thiazole In dichloromethane at 20℃; for 6h; Product distribution / selectivity; Resolution of racemate;	A n/a B n/a C n/a D n/a

...Expand

: 1213788-21-6
(R,S)-N-ketoprofenyl-1,2,4-triazole

A: 1213788-33-0
(S)-N-ketoprofenyl-1,2,4-triazole

B: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
With Novozym 435; water In tert-butyl methyl ether at 45℃; Kinetics; Solvent; Concentration;

: 57872-48-7, 81601-91-4, 81601-93-6, 47087-07-0
ketoprofen methyl ester

A: 56105-81-8
R-ketoprofen

B: methyl (2S)-2-(3-benzoylphenyl)propanoate

C: 81601-93-6
(R)-(-)-2-(3-benzoylphenyl)propionic acid methyl ester

Conditions

Conditions	Yield
With Novozym 435; water In tert-butyl methyl ether at 45℃; Kinetics; Solvent; Concentration; optical yield given as %ee;

...Expand

: 4-nitrophenyl 2-(3-benzoylphenyl)propanoate

A: C22H17NO5

B: C22H17NO5

C: 22161-81-5
S-ketoprofen

D: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
Stage #1: 4-nitrophenyl 2-(3-benzoylphenyl)propanoate With Pseudomonas aeruginosa lipase Met16Ala/Leu17Phe/Leu162Asn mutant In acetonitrile at 30℃; for 1.5h; pH=7.5; aq. phosphate buffer; Resolution of racemate; Enzymatic reaction; Stage #2: With hydrogenchloride In water; acetonitrile enantioselective reaction;

...Expand

: 22071-15-4
ketoprofen

: 110282-71-8
9,9‘-bis-phenanthrylmethanol

A: 1187670-14-9
(R)-ketoprofen di(9-phenanthryl)methyl ester

B: (S)-ketoprofen di(9-phenanthryl)methyl ester

C: 22161-81-5
S-ketoprofen

D: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
With p-Methoxybenzoic anhydride; N-ethyl-N,N-diisopropylamine; (R)-(+)-2-phenyl-2,3-dihydrobenzo[d]imidazo[2,1-b]thiazole In dichloromethane at 20℃; for 12h; Product distribution / selectivity; Resolution of racemate;	A n/a B n/a C n/a D n/a
With (R)-(+)-2-phenyl-2,3-dihydrobenzo[d]imidazo[2,1-b]thiazole; p-Methoxybenzoic anhydride; N-ethyl-N,N-diisopropylamine In dichloromethane at 20℃; for 12h; optical yield given as %ee; enantioselective reaction;

...Expand

: 1268613-74-6
C19H15BrN2O2

A: 1268614-30-7
C19H15BrN2O2

B: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
With Candida antarctica lipase B; water In tert-butyl methyl ether at 45℃; for 2h; Resolution of racemate; Enzymatic reaction; optical yield given as %ee; enantioselective reaction;

: C26H22O4

A: 22161-81-5
S-ketoprofen

B: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
With copper(l) chloride In methanol at 40℃; Inert atmosphere; optical yield given as %ee;

: 150360-24-0
2-methyl-2-(3-benzoylphenyl)malonic acid

: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
With Mesorhizobium sp. BNC1 arylmalonate decarboxylase Enzymatic reaction; enantioselective reaction;

: 60658-04-0
ethyl 2-<3-benzoylphenyl>propionate

A: 22161-81-5
S-ketoprofen

B: 56105-81-8
R-ketoprofen

Conditions

Conditions	Yield
With Thermotoga maritima esterase Tm1160 In aq. acetate buffer at 70℃; for 32h; pH=5.5; Enzymatic reaction; enantioselective reaction;	A n/a B n/a

: 60658-04-0
ethyl 2-<3-benzoylphenyl>propionate

A: 22161-81-5
S-ketoprofen

B: 56105-81-8
R-ketoprofen

C: methyl (2S)-2-(3-benzoylphenyl)propanoate

D: 81601-93-6
(R)-(-)-2-(3-benzoylphenyl)propionic acid methyl ester

Conditions

Conditions	Yield
With Yarrowia lipolytica Lip2p lipase In decane at 20℃; for 100h; Kinetics; Enzymatic reaction; enantioselective reaction;

...Expand

: 60658-04-0
ethyl 2-<3-benzoylphenyl>propionate

A: 56105-81-8
R-ketoprofen

B: methyl (2S)-2-(3-benzoylphenyl)propanoate

Conditions

Conditions	Yield
With Candida rugose lipase CRL4 10X In decane at 20℃; for 100h; Kinetics; Enzymatic reaction; enantioselective reaction;

: 71-23-8
propan-1-ol

: 56105-81-8
R-ketoprofen

: (R)-2-(3-Benzoyl-phenyl)-propionic acid propyl ester

Conditions

Conditions	Yield
In 2,2,4-trimethylpentane at 30℃; lyophilized crude lipase (olive oil);	85%

: 56105-81-8
R-ketoprofen

: 109-55-7
1-amino-3-(dimethylamino)propane

: (R)-2-[(3-benzoyl)phenyl]-N-[3-(dimethylamino)propyl]propionamide

Conditions

Conditions	Yield
Stage #1: R-ketoprofen With benzotriazol-1-ol; dicyclohexyl-carbodiimide In dichloromethane at 20℃; for 0.5h; Stage #2: 1-amino-3-(dimethylamino)propane In dichloromethane at 20℃;	75%

: 3144-09-0
methanesulfonamide

: 56105-81-8
R-ketoprofen

: DF 1661

Conditions

Conditions	Yield
Stage #1: R-ketoprofen With 1,1'-carbonyldiimidazole In dichloromethane at 0 - 5℃; for 2h; Stage #2: methanesulfonamide With 1,2-diazabicyclo[5.4.0]undec-7-ene In dichloromethane for 4h;	74%

: 474-77-1
epicholesterol

: 56105-81-8
R-ketoprofen

: 913843-20-6
epi-cholesteryl (R)-2-(3-benzoylphenyl)propionate

Conditions

Conditions	Yield
Stage #1: R-ketoprofen With dicyclohexyl-carbodiimide In dichloromethane at 0℃; for 0.5h; Stage #2: epicholesterol With dmap In dichloromethane at 0℃; for 8h;	74%

: 85-61-0, 31416-98-5
coenzyme A

: 56105-81-8
R-ketoprofen

: C37H48N7O18P3S

Conditions

Conditions	Yield
Stage #1: R-ketoprofen With 2,6-dimethylpyridine; chloroformic acid ethyl ester In dichloromethane at 20℃; for 1h; Stage #2: coenzyme A With sodium hydroxide In tetrahydrofuran; water at 20℃; for 2h; pH=6.2;

: 67-56-1
methanol

: 56105-81-8
R-ketoprofen

: 81601-93-6
(R)-(-)-2-(3-benzoylphenyl)propionic acid methyl ester

Conditions

Conditions	Yield
With sulfuric acid at 20℃;
With sulfuric acid at 80℃;

: 5680-79-5
glycine ethyl ester hydrochloride

: 56105-81-8
R-ketoprofen

: [(R)-2-(3-Benzoyl-phenyl)-propionylamino]-acetic acid methyl ester

Conditions

Conditions	Yield
Stage #1: R-ketoprofen With 1-hydroxybenzotriazol-hydrate; dicyclohexyl-carbodiimide In N,N-dimethyl-formamide at 0 - 5℃; for 1h; Stage #2: glycine ethyl ester hydrochloride In N,N-dimethyl-formamide at 20℃;

: 56105-81-8
R-ketoprofen

: (R)-2-(3-Benzoyl-phenyl)-propionyl chloride

Conditions

Conditions	Yield
With thionyl chloride for 3h; Heating;

: 57-88-5
cholesterol

: 56105-81-8
R-ketoprofen

: 913843-20-6
epi-cholesteryl (R)-2-(3-benzoylphenyl)propionate

Conditions

Conditions	Yield
Mitsunobu reaction;

: 56105-81-8
R-ketoprofen

: 66067-43-4
3-ethylbenzophenone

Conditions

Conditions	Yield
In phosphate buffer at 25℃; pH=7.4; Quantum yield; Kinetics; Further Variations:; Reagents; Photolysis;

: 56105-81-8
R-ketoprofen

: 875294-84-1
methyl (2R)-2-[3-(1-phenylethyl)phenyl]propanoate

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1.1: H2SO4 / 20 °C 2.1: n-BuLi / tetrahydrofuran; hexane / 3 h / 0 - 5 °C 2.2: 71 percent / tetrahydrofuran; hexane / 20 °C 3.1: H2 / Pd/C / ethanol / 18 h View Scheme

: 56105-81-8
R-ketoprofen

: 454701-83-8
(R),(R',S')-2-[3-(α-methylbenzyl)phenyl]propionyl chloride

Conditions

Conditions	Yield
Multi-step reaction with 5 steps 1.1: H2SO4 / 20 °C 2.1: n-BuLi / tetrahydrofuran; hexane / 3 h / 0 - 5 °C 2.2: 71 percent / tetrahydrofuran; hexane / 20 °C 3.1: H2 / Pd/C / ethanol / 18 h 4.1: 0.29 g / aq. KOH / dioxane / 20 °C 5.1: SOCl2 / 8 h / Heating View Scheme

: 56105-81-8
R-ketoprofen

: 354904-38-4
(2R)-2-[3-(1-phenylethyl)phenyl]propanoic acid

Conditions

Conditions	Yield
Multi-step reaction with 4 steps 1.1: H2SO4 / 20 °C 2.1: n-BuLi / tetrahydrofuran; hexane / 3 h / 0 - 5 °C 2.2: 71 percent / tetrahydrofuran; hexane / 20 °C 3.1: H2 / Pd/C / ethanol / 18 h 4.1: 0.29 g / aq. KOH / dioxane / 20 °C View Scheme

: 56105-81-8
R-ketoprofen

: 859828-61-8
methyl (2R)-2-[3-(1-phenylvinyl)phenyl]propanoate

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1.1: H2SO4 / 20 °C 2.1: n-BuLi / tetrahydrofuran; hexane / 3 h / 0 - 5 °C 2.2: 71 percent / tetrahydrofuran; hexane / 20 °C View Scheme

: 56105-81-8
R-ketoprofen

: N-{2-[3-(1-phenyl-ethyl)-phenyl]-propionyl}-methanesulfonamide

Conditions

Conditions	Yield
Multi-step reaction with 5 steps 1.1: H2SO4 / 20 °C 2.1: n-BuLi / tetrahydrofuran; hexane / 3 h / 0 - 5 °C 2.2: 71 percent / tetrahydrofuran; hexane / 20 °C 3.1: H2 / Pd/C / ethanol / 18 h 4.1: 0.29 g / aq. KOH / dioxane / 20 °C 5.1: 1,1'-carbonyldiimidazole / CH2Cl2 / 2 h / 0 - 5 °C 5.2: 30 percent / diazabicyclo[5.4.0]undec-7-ene / CH2Cl2 / 4 h View Scheme

: 56105-81-8
R-ketoprofen

: [(R)-2-(3-Benzoyl-phenyl)-propionylamino]-acetic acid

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1.1: 1-hydroxybenzotriazole hydrate; 1,3-dicyclohexylcarbodiimide / dimethylformamide / 1 h / 0 - 5 °C 1.2: dimethylformamide / 20 °C 2.1: 0.31 g / aq. NaOH / dioxane / 20 °C View Scheme

Benzeneacetic acid,3-benzoyl-a-methyl-, (aR)- Specification

The Benzeneacetic acid,3-benzoyl-a-methyl-, (aR)-, with CAS registry number 56105-81-8, has the systematic name of (2R)-2-(3-benzoylphenyl)propanoic acid. Besides this, it is also called (R)-2-(3-Benzoylphenyl)propionic acid. And the chemical formula of this chemical is C₁₆H₁₄O₃.

Physical properties of Benzeneacetic acid,3-benzoyl-a-methyl-, (aR)-: (1)ACD/LogP: 2.91; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.621; (4)ACD/BCF (pH 5.5): 4.93; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 46.899; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 54.37 Å²; (12)Index of Refraction: 1.592; (13)Molar Refractivity: 71.795 cm³; (14)Molar Volume: 212.246 cm³; (15)Polarizability: 28.462×10^-24cm³; (16)Surface Tension: 49.771 dyne/cm; (17)Density: 1.198 g/cm³; (18)Flash Point: 228.793 °C; (19)Enthalpy of Vaporization: 72.408 kJ/mol; (20)Boiling Point: 431.316 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25°C.

Preparation: this chemical can be prepared by 2-(3-benzoyl-phenyl)-propionic acid 2,2,2-trifluoro-ethyl ester. This reaction will need reagents Pseudomonas fluorescens MTCCB0015 cell-free extract, NaOH and solvent aq. phosphate buffer. The reaction time is 20 hour(s) with reaction temperature of 37 ℃. The yield is about 40%.

You can still convert the following datas into molecular structure:
(1)SMILES: C[C@H](c1cccc(c1)C(=O)c2ccccc2)C(=O)O
(2)InChI: InChI=1/C16H14O3/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)/t11-/m1/s1
(3)InChIKey: DKYWVDODHFEZIM-LLVKDONJBL
(4)Std. InChI: InChI=1S/C16H14O3/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)/t11-/m1/s1
(5)Std. InChIKey: DKYWVDODHFEZIM-LLVKDONJSA-N

Product Name

(2R)-2-(3-benzoylphenyl)propanoic acid

Synthetic route

Benzeneacetic acid,3-benzoyl-a-methyl-, (aR)- Specification

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