Product Name

  • Name

    2-((4-Chlorophenyl)acetyl)benzoic acid

  • EINECS 258-444-8
  • CAS No. 53242-76-5
  • Article Data3
  • CAS DataBase
  • Density 1.332 g/cm3
  • Solubility
  • Melting Point
  • Formula C15H11ClO3
  • Boiling Point 456.8 °C at 760 mmHg
  • Molecular Weight 274.704
  • Flash Point 230.1 °C
  • Transport Information
  • Appearance off-white crystalline powder
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 53242-76-5 (2-((4-Chlorophenyl)acetyl)benzoic acid)
  • Hazard Symbols
  • Synonyms Benzoicacid, 2-[(4-chlorophenyl)acetyl]- (9CI);
  • PSA 54.37000
  • LogP 3.46360

Synthetic route

4-chlorophenylacetic Acid
1878-66-6

4-chlorophenylacetic Acid

phthalic anhydride
85-44-9

phthalic anhydride

2‐(4-chlorophenylacetyl)benzoic acid
53242-76-5

2‐(4-chlorophenylacetyl)benzoic acid

Conditions
ConditionsYield
Stage #1: 4-chlorophenylacetic Acid; phthalic anhydride With sodium acetate at 240 - 250℃; for 3h;
Stage #2: With water; sodium hydroxide In water for 4h; Time; Reflux;
80%
(Z)-3-(4-chlorophenyl)methylidenephthalide
105279-16-1

(Z)-3-(4-chlorophenyl)methylidenephthalide

2‐(4-chlorophenylacetyl)benzoic acid
53242-76-5

2‐(4-chlorophenylacetyl)benzoic acid

Conditions
ConditionsYield
With sodium hydroxide for 2h; Heating; Yield given;
4-chlorophenylacetic Acid
1878-66-6

4-chlorophenylacetic Acid

2‐(4-chlorophenylacetyl)benzoic acid
53242-76-5

2‐(4-chlorophenylacetyl)benzoic acid

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: CH3COONa / 3 h / 245 - 250 °C
2: aq. NaOH / 2 h / Heating
View Scheme
phthalic anhydride
85-44-9

phthalic anhydride

3-<2-carboxy-phenyl>-pyridine-carboxylic acid-(2)

3-<2-carboxy-phenyl>-pyridine-carboxylic acid-(2)

2‐(4-chlorophenylacetyl)benzoic acid
53242-76-5

2‐(4-chlorophenylacetyl)benzoic acid

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: CH3COONa / 3 h / 245 - 250 °C
2: aq. NaOH / 2 h / Heating
View Scheme
3-(4-chlorobenzylidene)-2-benzofuran-1(3H)-one
20526-97-0

3-(4-chlorobenzylidene)-2-benzofuran-1(3H)-one

2‐(4-chlorophenylacetyl)benzoic acid
53242-76-5

2‐(4-chlorophenylacetyl)benzoic acid

Conditions
ConditionsYield
With potassium hydroxide In ethanol; water
2‐(4-chlorophenylacetyl)benzoic acid
53242-76-5

2‐(4-chlorophenylacetyl)benzoic acid

(Z)-3-(4-chlorophenyl)methylidenephthalide
105279-16-1

(Z)-3-(4-chlorophenyl)methylidenephthalide

Conditions
ConditionsYield
With O-(N-succinimidyl)-N,N,N',N'-tetramethyluronium tetrafluoroborate; N-ethyl-N,N-diisopropylamine In dichloromethane at 20℃; for 12h; Inert atmosphere;91%
2‐(4-chlorophenylacetyl)benzoic acid
53242-76-5

2‐(4-chlorophenylacetyl)benzoic acid

4-[(4-chlorophenyl)methyl]-1(2H)-phthalazinone
53242-88-9

4-[(4-chlorophenyl)methyl]-1(2H)-phthalazinone

Conditions
ConditionsYield
With sodium hydroxide; hydrazinium sulfate for 2h; Heating;90%
2‐(4-chlorophenylacetyl)benzoic acid
53242-76-5

2‐(4-chlorophenylacetyl)benzoic acid

methyl 2-(4-chlorophenylacetyl)benzoate
61653-04-1

methyl 2-(4-chlorophenylacetyl)benzoate

Conditions
ConditionsYield
In diethyl ether
2‐(4-chlorophenylacetyl)benzoic acid
53242-76-5

2‐(4-chlorophenylacetyl)benzoic acid

2-Benzoyl-1-(hexahydro-1-methyl-1H-azepin-4-yl)hydrazin-hydrochlorid

2-Benzoyl-1-(hexahydro-1-methyl-1H-azepin-4-yl)hydrazin-hydrochlorid

azelastine
58581-89-8

azelastine

Conditions
ConditionsYield
With hydrogenchloride; potassium hydroxide 1.) reflux, 3 h, 2.) methanol, reflux, 2 h; Yield given. Multistep reaction;
2‐(4-chlorophenylacetyl)benzoic acid
53242-76-5

2‐(4-chlorophenylacetyl)benzoic acid

4-(p-Chlorbenzyl)-2-<2-(N-methylpyrrolidin-2-yl)-ethyl>-1(2H)-phthalazinon

4-(p-Chlorbenzyl)-2-<2-(N-methylpyrrolidin-2-yl)-ethyl>-1(2H)-phthalazinon

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: 90 percent / hydrazine sulfate, aq. NaOH / 2 h / Heating
2: aq. NaOH / 1 h / 70 °C
View Scheme
2‐(4-chlorophenylacetyl)benzoic acid
53242-76-5

2‐(4-chlorophenylacetyl)benzoic acid

azelastine
58581-89-8

azelastine

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: 90 percent / hydrazine sulfate, aq. NaOH / 2 h / Heating
2: aq. NaOH / 1 h / 70 °C
View Scheme
1H-azepine, 4-hydrazinohexahydro-1-methyl, dihydrochloride

1H-azepine, 4-hydrazinohexahydro-1-methyl, dihydrochloride

2‐(4-chlorophenylacetyl)benzoic acid
53242-76-5

2‐(4-chlorophenylacetyl)benzoic acid

azelastine
58581-89-8

azelastine

Conditions
ConditionsYield
Stage #1: 1H-azepine, 4-hydrazinohexahydro-1-methyl, dihydrochloride; 2‐(4-chlorophenylacetyl)benzoic acid With sodium hydroxide In methanol; water for 4h; Heating / reflux;
Stage #2: With hydrogenchloride In methanol; 2,8-dimethylnonan-5-one; water
ethyl iodide
75-03-6

ethyl iodide

2‐(4-chlorophenylacetyl)benzoic acid
53242-76-5

2‐(4-chlorophenylacetyl)benzoic acid

ethyl 2-(2-(4-chlorophenyl)acetyl)benzoate
1107016-94-3

ethyl 2-(2-(4-chlorophenyl)acetyl)benzoate

Conditions
ConditionsYield
With potassium fluoride In N,N-dimethyl-formamide
C14H23N3O(2+)*C4H2O4(2-)

C14H23N3O(2+)*C4H2O4(2-)

2‐(4-chlorophenylacetyl)benzoic acid
53242-76-5

2‐(4-chlorophenylacetyl)benzoic acid

azelastine
58581-89-8

azelastine

Conditions
ConditionsYield
Stage #1: C14H23N3O(2+)*C4H2O4(2-) With hydrogenchloride at 20℃; for 2h; Reflux;
Stage #2: 2‐(4-chlorophenylacetyl)benzoic acid for 2h; Reflux;
8.1 g
C14H23N3O(2+)*C4H2O4(2-)

C14H23N3O(2+)*C4H2O4(2-)

2‐(4-chlorophenylacetyl)benzoic acid
53242-76-5

2‐(4-chlorophenylacetyl)benzoic acid

azelastine
58581-89-8

azelastine

Conditions
ConditionsYield
Stage #1: C14H23N3O(2+)*C4H2O4(2-) With hydrogenchloride at 20℃; for 2h; Reflux;
Stage #2: 2‐(4-chlorophenylacetyl)benzoic acid for 2h; Reflux;
7.5 g
C14H23N3O(2+)*C4H4O4(2-)

C14H23N3O(2+)*C4H4O4(2-)

2‐(4-chlorophenylacetyl)benzoic acid
53242-76-5

2‐(4-chlorophenylacetyl)benzoic acid

azelastine
58581-89-8

azelastine

Conditions
ConditionsYield
Stage #1: C14H23N3O(2+)*C4H4O4(2-) With hydrogenchloride at 20℃; for 2h; Reflux;
Stage #2: 2‐(4-chlorophenylacetyl)benzoic acid for 2h; Reflux;
8 g

2-((4-Chlorophenyl)acetyl)benzoic acid Chemical Properties

IUPAC name: 2-[2-(4-Chlorophenyl)acetyl]benzoic acid
Molecular Formula: C15H11ClO3
Molecular Weight: 274.70 g/mol
EINECS: 258-444-8
Index of Refraction: 1.621
Surface Tension: 55.4 dyne/cm
Density: 1.332 g/cm3
Flash Point: 230.1 °C
Enthalpy of Vaporization: 75.54 kJ/mol
Boiling Point: 456.8 °C at 760 mmHg
Vapour Pressure: 3.87E-09 mmHg at 25 °C 
Product Category of 2-((4-Chlorophenyl)acetyl)benzoic acid (CAS NO.53242-76-5): Organic acids;(intermediate of azelastine hcl)
Following is the structure of 2-((4-Chlorophenyl)acetyl)benzoic acid (CAS NO.53242-76-5):
            
Canonical SMILES: C1=CC=C(C(=C1)C(=O)CC2=CC=C(C=C2)Cl)C(=O)O
InChI: InChI=1S/C15H11ClO3/c16-11-7-5-10(6-8-11)9-14(17)12-3-1-2-4-13(12)15(18)19/h1-8H,9H2,(H,18,19)
InChIKey: BDSINYHJZLINDJ-UHFFFAOYSA-N

2-((4-Chlorophenyl)acetyl)benzoic acid Specification

 2-((4-Chlorophenyl)acetyl)benzoic acid , its cas register number is 53242-76-5. It also can be called 2-[2-(4-Chlorophenyl)acetyl]benzoic acid .

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