Methyl 2-chlorobenzoate supplier

Name
Methyl 2-chlorobenzoate
EINECS 210-242-0
CAS No. 610-96-8
Article Data145
CAS DataBase
Density 1.224 g/cm³
Solubility 567 mg/L at 25 °C in water
Melting Point 233-235 °C
Formula C₈H₇ClO₂
Boiling Point 225.4 °C at 760 mmHg
Molecular Weight 170.595
Flash Point 101.7 °C
Transport Information
Appearance White to light yellow crystal powder
Safety 24/25
Risk Codes R36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms Benzoicacid, o-chloro-, methyl ester (6CI,7CI,8CI);2-Chlorobenzoic acid methyl ester;Methyl 2-chlorobenzoate;Methyl o-chlorobenzoate;NSC 7320;
PSA 26.30000
LogP 2.12660

Synthetic route

: 67-56-1
methanol

: 118-91-2
ortho-chlorobenzoic acid

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
With sulfuric acid for 4h; Reflux;	100%
With sulfuric acid Heating;	99%
With 1,3,5-trichloro-2,4,6-triazine; sodium carbonate at 50℃; for 0.333333h; Sonication;	94%

: 75-91-2
tert.-butylhydroperoxide

: 89-98-5
2-chloro-benzaldehyde

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
Stage #1: tert.-butylhydroperoxide; 2-chloro-benzaldehyde In water; dimethyl sulfoxide Stage #2: In water; dimethyl sulfoxide at 100℃; for 20h; Sealed tube;	99%

: 10345-79-6
N,N-Diethyl-2-chlorobenzamide

: 420-37-1
trimethoxonium tetrafluoroborate

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
Stage #1: N,N-Diethyl-2-chlorobenzamide; trimethoxonium tetrafluoroborate With disodium hydrogenphosphate In acetonitrile at 20℃; Methylation; Stage #2: With sodium hydrogencarbonate for 18h; Hydrolysis;	98%

: 14920-87-7
2,6-dichlorobenzoic acid methyl ester

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
With methanol; sodium hydroxide In water Electrolysis;	98%

: 67-56-1
methanol

: 13524-04-4
2'-chloro-sec-phenethyl alcohol

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
With N-iodo-succinimide; 1,10-Phenanthroline; oxygen; potassium carbonate; copper dichloride In dimethyl sulfoxide at 140℃; under 3750.38 Torr; for 12h; Molecular sieve;	98%
With oxygen; potassium carbonate at 150℃; under 4500.45 Torr; for 24h; Autoclave;	78 %Chromat.

: 67-56-1
methanol

: 89-98-5
2-chloro-benzaldehyde

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
With dihydrogen peroxide; bromine In dichloromethane; water for 4h; Reflux;	97%
With aluminium(III) chloride hexahydrate; urea hydrogen peroxide adduct at 60℃; Green chemistry;	93%
With bis(acetylacetonate)oxovanadium; dihydrogen peroxide at 20℃; for 5.3h; Reagent/catalyst;	89%

: 67-56-1
methanol

: 201230-82-2
carbon monoxide

: 615-41-8
2-iodochlorobenzene

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
With C57H43IP2Pd; triethylamine at 90℃; under 3750.38 Torr; for 12h; Autoclave;	97%

...Expand

: 67-56-1
methanol

: 609-65-4
o-chlorobenzoyl chloride

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
With triethylamine at 20℃; for 10h;	95%

: 6526-67-6
N,N-dimethyl-o-chlorobenzamide

: 420-37-1
trimethoxonium tetrafluoroborate

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
Stage #1: N,N-dimethyl-o-chlorobenzamide; trimethoxonium tetrafluoroborate With disodium hydrogenphosphate In acetonitrile at 20℃; Methylation; Stage #2: With sodium hydrogencarbonate for 18h; Hydrolysis;	95%

: 110-05-4
di-tert-butyl peroxide

: 118-91-2
ortho-chlorobenzoic acid

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
With copper(l) chloride In chlorobenzene at 130℃; for 12h; Schlenk technique; Inert atmosphere;	95%

: 67-56-1
methanol

: (1-phenyl-1H-imidazol-2-yl)(2-chlorophenyl)methanone

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
at 100℃; for 12h; Autoclave; Inert atmosphere;	94%

: 67-56-1
methanol

: 694-80-4
2-bromo-1-chlorobenzene

: 201230-82-2
carbon monoxide

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
With benzophenone; sodium methylate; cobalt(II) acetate at 40℃; under 750.075 Torr; for 15h; Irradiation;	93%

...Expand

: 67-56-1
methanol

: 17849-38-6
2-Chlorobenzyl alcohol

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
Stage #1: methanol With sodium tetrachloroaurate(III) dihyrate; potassium carbonate at 20℃; for 0.0166667h; Green chemistry; Stage #2: 2-Chlorobenzyl alcohol at 20℃; for 0.0333333h; Green chemistry; Stage #3: With oxygen at 80℃; under 760.051 Torr; Autoclave; Green chemistry;	90%
With Au#Co; oxygen; potassium carbonate at 80℃; under 750.075 Torr; for 10h; Autoclave;	90%
With oxygen; potassium carbonate at 60℃; under 760.051 Torr; for 12h;	90%

: 2142-68-9
1-(2-chlorophenyl)ethanone

A: 610-96-8
methyl chlorobenzoate

B: 4525-75-1
2-chlorophenyl acetate

Conditions

Conditions	Yield
With hydrogenchloride In chloroform at 20℃; for 12h; Baeyer-Villiger oxidation;	A 6% B 90%

: 118-91-2
ortho-chlorobenzoic acid

: 119-36-8
methyl salicylate

A: 610-96-8
methyl chlorobenzoate

B: 69-72-7
salicylic acid

Conditions

Conditions	Yield
Stage #1: ortho-chlorobenzoic acid With potassium carbonate In N,N-dimethyl acetamide at 110℃; for 0.5h; Stage #2: methyl salicylate at 110℃; for 24h;	A 90% B n/a

...Expand

: 4731-65-1
tris(o-methoxyphenyl)phosphine

: 118-91-2
ortho-chlorobenzoic acid

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
With dirhodium tetraacetate In cyclohexane at 120℃; for 12h; Schlenk technique; Inert atmosphere;	89%

: 67-56-1
methanol

: 609-66-5
2-chlorobenzamide

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
With potassium hydrogensulfate at 65℃; for 72h;	89%

: 67-56-1
methanol

: 21854-95-5
2,2'-dichlorobenzil

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
With sodium cyanide; potassium iodide at 15℃; Electrochemical reaction;	85%

: 77-78-1
dimethyl sulfate

: 118-91-2
ortho-chlorobenzoic acid

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
With lithium hydroxide In tetrahydrofuran for 2h; Methylation; esterification; Heating;	80%

: 13516-02-4
anthranilic acid methyl ester hydrochloride

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
Stage #1: anthranilic acid methyl ester hydrochloride With isopentyl nitrite In acetone at 0 - 15℃; Stage #2: With copper dichloride In ethanol; acetone at 10 - 20℃; Sandmeyer Reaction;	80%

: 67-56-1
methanol

: 694-80-4
2-bromo-1-chlorobenzene

: 201230-82-2
carbon monoxide

A: 610-96-8
methyl chlorobenzoate

B: 131-11-3
phthalic acid dimethyl ester

C: 118-91-2
ortho-chlorobenzoic acid

Conditions

Conditions	Yield
With tert-Amyl alcohol; sodium hydride; cobalt(II) acetate In tetrahydrofuran at 40℃; under 760 Torr; for 10h; Irradiation;	A 76% B 12% C 3%

...Expand

: 694-80-4
2-bromo-1-chlorobenzene

: 201230-82-2
carbon monoxide

A: 610-96-8
methyl chlorobenzoate

B: 131-11-3
phthalic acid dimethyl ester

C: 118-91-2
ortho-chlorobenzoic acid

Conditions

Conditions	Yield
With methanol; tert-Amyl alcohol; sodium hydride; cobalt(II) acetate In tetrahydrofuran at 40℃; under 760 Torr; for 10h; Irradiation;	A 76% B 12% C 3%

...Expand

: 67-56-1
methanol

: 2136-89-2
2-chlorobenzotrichloride

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
at 20℃; for 3h; UV-irradiation;	75%

: 17287-03-5
trimethylsulphonium hydroxide

: 118-91-2
ortho-chlorobenzoic acid

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
In ethyl acetate at 20℃; for 2h; Esterification;	74%

: 67-56-1
methanol

: 89-98-5
2-chloro-benzaldehyde

A: 610-96-8
methyl chlorobenzoate

B: 118-91-2
ortho-chlorobenzoic acid

Conditions

Conditions	Yield
With dihydrogen peroxide at 20 - 70℃; for 12h; Green chemistry;	A 74% B 16%
With 3,3'-dimethyl-1,1'-(hexane-1,6-diyl)diimidazolium glutarate; 1,8-diazabicyclo[5.4.0]undec-7-ene In tetrahydrofuran at 55℃; for 16h; Molecular sieve;	A 8% B 32%
With dihydrogen peroxide at 80℃; for 6h; Catalytic behavior; Dean-Stark;

...Expand

: 18292-38-1
2-methallyltrimethylsilane

: 156573-32-9
methyl 2-chloro-4-iodobenzoate

A: 610-96-8
methyl chlorobenzoate

B: methyl 2-chloro-4-(2-methylallyl)benzoate

Conditions

Conditions	Yield
With cesium fluoride In acetonitrile at -78 - 25℃; for 24h; Irradiation; Sealed tube; Inert atmosphere;	A n/a B 73%

...Expand

: 118-91-2
ortho-chlorobenzoic acid

: 594-09-2
trimethylphosphane

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
With 1,3-diazido-propane In neat (no solvent) at 20℃; for 0.333333h;	72%

: 59579-08-7
2-methoxymethylchlorobenzene

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
With oxygen In water at 25℃; for 12h; Irradiation; Green chemistry;	71%

: 93-58-3
benzoic acid methyl ester

: 610-96-8
methyl chlorobenzoate

Conditions

Conditions	Yield
With N-chloro-succinimide; silver hexafluoroantimonate; trifluorormethanesulfonic acid; nickel diacetate In 1,2-dichloro-ethane at 80℃; for 12h; regioselective reaction;	69%

: 67-56-1
methanol

: 201230-82-2
carbon monoxide

: 95-50-1
1,2-dichloro-benzene

A: 610-96-8
methyl chlorobenzoate

B: 118-91-2
ortho-chlorobenzoic acid

Conditions

Conditions	Yield
With tert-Amyl alcohol; sodium hydride; cobalt(II) acetate In tetrahydrofuran at 40℃; under 760 Torr; for 71h; Irradiation;	A 61% B 17%

...Expand

: 610-96-8
methyl chlorobenzoate

: 17849-38-6
2-Chlorobenzyl alcohol

Conditions

Conditions	Yield
With sodium tetrahydroborate In 1,4-dioxane; water for 6h; Ambient temperature;	100%
With methanol; sodium tetrahydroborate In tetrahydrofuran at 65℃; for 2h;	97%
With C31H26ClN2OPRu; hydrogen; sodium methylate In tetrahydrofuran at 80℃; for 5h;	94%

: 610-96-8
methyl chlorobenzoate

: 118-91-2
ortho-chlorobenzoic acid

Conditions

Conditions	Yield
With sodium; diphenyldisulfane In 1-methyl-pyrrolidin-2-one at 90℃; for 0.25h;	100%
With iodine; aluminium In acetonitrile at 80℃; for 18h;	98%
With potassium hydroxide In toluene at 150℃; for 0.166667h; microwave irradiation;	97%

: 610-96-8
methyl chlorobenzoate

: (2,3-dimethylphenyl)zinc chloride

: 2-carbomethoxy-2',3'-dimethylbiphenyl

Conditions

Conditions	Yield
With tris(dibenzylideneacetone)dipalladium (0); ruphos In tetrahydrofuran at 70℃; Negishi coupling;	100%

: 610-96-8
methyl chlorobenzoate

: 5418-86-0
tris(methylthio)methane

: 1-(2-Chloro-phenyl)-2,2,2-tris-methylsulfanyl-ethanone

Conditions

Conditions	Yield
With n-butyllithium In tetrahydrofuran; hexane at -95℃;	98%

: 610-96-8
methyl chlorobenzoate

: 5720-06-9
2-Methoxyphenylboronic acid

: 63506-58-1
2'-methoxy-biphenyl-2-carboxylic acid methyl ester

Conditions

Conditions	Yield
With (2’,4’,6’-triisopropyl-[1,1’-biphenyl]-2-yl)-diphenylphosphine; potassium phosphate; palladium diacetate In tetrahydrofuran at 20℃; for 24h; Suzuki-Miyaura coupling;	98%

: 905966-40-7
methyl 4-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzoate

: 610-96-8
methyl chlorobenzoate

: 55676-77-2
dimethyl (1,1'-biphenyl)-2,4'-dicarboxylate

Conditions

Conditions	Yield
With potassium phosphate tribasic hydrate; NiIICl(1-naphthyl)(tricyclohexylphosphine)2; tricyclohexylphosphine In tetrahydrofuran at 23℃; for 2h; Suzuki-Miyaura Coupling; Inert atmosphere; Glovebox; Sealed tube;	98%

: 610-96-8
methyl chlorobenzoate

: 213596-33-9
2-(4-methoxyphenyl)-5,5-dimethyl-1,3,2-dioxaborolane

: 17103-25-2
methyl 4'-methoxybiphenyl-2-carboxylate

Conditions

Conditions	Yield
With potassium phosphate tribasic hydrate; NiIICl(1-naphthyl)(tricyclohexylphosphine)2; tricyclohexylphosphine In tetrahydrofuran at 23℃; for 4h; Suzuki-Miyaura Coupling; Inert atmosphere; Glovebox; Sealed tube;	98%

: 610-96-8
methyl chlorobenzoate

: 73183-34-3
bis(pinacol)diborane

: methyl 2-chloro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate

Conditions

Conditions	Yield
With bis(1,5-cyclooctadiene)diiridium(I) dichloride; 2-(dimethyl(phenyl)silyl)-1-(6-methoxypyridin-2-yl)-2,3-dihydro-1H-naphtho[1,8-de]-[1,3,2]diazaborinine In hexane at 80℃; for 20h; Schlenk technique; Inert atmosphere;	98%
With (1,5-cyclooctadiene)(methoxy)iridium(I) dimer; diisopropyl(2-(isopropylthio)phenyl)silane In 2-methyltetrahydrofuran at 80℃; for 16h; Inert atmosphere;	83%
With (1,5-cyclooctadiene)(methoxy)iridium(I) dimer; diisopropyl(2-(isopropylthio)phenyl)silane In 2-methyltetrahydrofuran at 80℃; for 16h; Sealed tube; Inert atmosphere; Glovebox; regioselective reaction;	68%

: 610-96-8
methyl chlorobenzoate

: 18854-66-5
tris(allyl)aluminum

: C13H15ClO

Conditions

Conditions	Yield
In diethyl ether at 20℃; for 0.5h;	97%

: 610-96-8
methyl chlorobenzoate

: 5814-05-1
2-chlorobenzoylhydrazide

Conditions

Conditions	Yield
With hydrazine hydrate at 20℃; for 2.5h; Cooling with ice;	96%
With hydrazine In methanol Reflux;	94%
With hydrazine hydrate In methanol Reflux;	90%

: 610-96-8
methyl chlorobenzoate

: 98-80-6
phenylboronic acid

: 16605-99-5
biphenyl-2-carboxylic acid methyl ester

Conditions

Conditions	Yield
With di-tert-butyl(2,2-diphenyl-1-methyl-1-cyclopropyl)phosphine; bis(η3-allyl-μ-chloropalladium(II)); potassium carbonate In toluene at 80℃; for 3h; Suzuki-Miyaura coupling;	96%
Stage #1: phenylboronic acid With potassium phosphate; N,N-diisopropyl 2-dicyclohexylphosphino-4-(3'-nitrophenyl)benzamide; palladium diacetate In tetrahydrofuran at 23℃; for 0.0166667h; Suzuki-Miyaura cross-coupling; Inert atmosphere; Stage #2: methyl chlorobenzoate In tetrahydrofuran; water at 23℃; for 40h; Suzuki-Miyaura cross-coupling; Inert atmosphere;	90%
With potassium phosphate; n-butyllithium; [1,1'-bis(diphenylphosphino)ferrocene]nickel(II) chloride; potassium iodide In 1,4-dioxane; hexane at 80℃; for 16h;	89%

: 610-96-8
methyl chlorobenzoate

: 668987-38-0
5,5-dimethyl-1,3,2-dioxaborinane

: 2-(5,5-dimethyl-[1,3,2]dioxaborinan-2-yl)-benzoic acid methyl ester

Conditions

Conditions	Yield
With 1,1'-bis-(diphenylphosphino)ferrocene; 1,3-bis[(diphenylphosphino)propane]dichloronickel(II); triethylamine; zinc In toluene at 100℃; for 1h; Inert atmosphere;	95%
With 1,1'-bis-(diphenylphosphino)ferrocene; 1,3-bis[(diphenylphosphino)propane]dichloronickel(II); triethylamine In toluene at 23 - 100℃; Inert atmosphere;	26%

: 610-96-8
methyl chlorobenzoate

: 100-58-3
phenylmagnesium bromide

: 16605-99-5
biphenyl-2-carboxylic acid methyl ester

Conditions

Conditions	Yield
Stage #1: methyl chlorobenzoate With dicyclohexyl-(2',6'-dimethoxybiphenyl-2-yl)-phosphane; palladium diacetate In tetrahydrofuran; toluene Kumada Cross-Coupling; Inert atmosphere; Sealed tube; Stage #2: phenylmagnesium bromide In tetrahydrofuran; toluene at 20℃; for 1h; Kumada Cross-Coupling; Inert atmosphere; Sealed tube; chemoselective reaction;	95%

: 610-96-8
methyl chlorobenzoate

: 380481-66-3
5,5-dimethyl-2-(4-methylphenyl)-1,3,2-dioxaborinane

: 114772-34-8
methyl 4'-methylbiphenyl-2-carboxylate

Conditions

Conditions	Yield
With potassium phosphate tribasic hydrate; NiIICl(1-naphthyl)(tricyclohexylphosphine)2; tricyclohexylphosphine In tetrahydrofuran at 23℃; for 4h; Suzuki-Miyaura Coupling; Inert atmosphere; Glovebox; Sealed tube;	94%

: 610-96-8
methyl chlorobenzoate

: 557-21-1
dicyanozinc

: 6587-24-2
methyl 2-cyanobenzoate

Conditions

Conditions	Yield
With zinc; 1,1'-bis-(diphenylphosphino)ferrocene; tris(dibenzylideneacetone)dipalladium (0) In N,N-dimethyl acetamide at 120℃; for 2h; Substitution;	93%

: 610-96-8
methyl chlorobenzoate

: 2-bromo-N-isopentylaniline

: 5-isopentylphenanthridin-6(5H)-one

Conditions

Conditions	Yield
With potassium phosphate; tris-(dibenzylideneacetone)dipalladium(0); bis(pinacol)diborane; tricyclohexylphosphine In 2-ethoxy-ethanol at 100℃; Inert atmosphere;	93%

: 610-96-8
methyl chlorobenzoate

: 5720-07-0
4-methoxyphenylboronic acid

: 17103-25-2
methyl 4'-methoxybiphenyl-2-carboxylate

Conditions

Conditions	Yield
With trans-chloro(9-phenanthrenyl)bis(triphenylphosphine)nickel(II); potassium carbonate; triphenylphosphine In toluene at 110℃; for 18h; Suzuki-Miyaura Coupling; Inert atmosphere;	92%

: 610-96-8
methyl chlorobenzoate

: 80-62-6
methacrylic acid methyl ester

: (E)-3-(2-carbomethoxyphenyl)-2-methyl acrylic acid methyl ester

Conditions

Conditions	Yield
With tris(dibenzylideneacetone)dipalladium (0); tri-tert-butyl phosphine; Cy2NMe2 In 1,4-dioxane at 20℃; for 24h; Heck coupling;	91%
With tris-(dibenzylideneacetone)dipalladium(0); tri-tert-butyl phosphine; N-Methyldicyclohexylamine In 1,4-dioxane at 20℃; Heck Reaction;	90%

Methyl 2-chlorobenzoate Chemical Properties

IUPAC Name: Methyl 2-chlorobenzoate
Canonical SMILES: COC(=O)C1=CC=CC=C1Cl
InChI: InChI=1S/C8H7ClO2/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5H,1H3
InChIKey: JAVRNIFMYIJXIE-UHFFFAOYSA-N
Molecular Weight: 170.59298 [g/mol]
Molecular Formula: C₈H₇ClO₂
XLogP3: 2.4
H-Bond Donor: 0
H-Bond Acceptor: 2
Water Solubility: 567 mg/L at 25 °C
EINECS: 210-242-0
Appearance: White to light yellow crystal powder
Melting Point: 233-235 °C
Index of Refraction: 1.528
Molar Refractivity: 42.92 cm³
Molar Volume: 139.2 cm³
Surface Tension: 38.9 dyne/cm
Density: 1.224 g/cm³
Flash Point: 101.7 °C
Enthalpy of Vaporization: 46.19 kJ/mol
Boiling Point: 225.4 °C at 760 mmHg
Vapour Pressure: 0.0868 mmHg at 25 °C
Product Categories of Benzoicacid, 2-chloro-, methyl ester (CAS NO.610-96-8): Aromatic Esters; pharmacetical; Benzoic acid; Acids & Esters; Chlorine Compounds; C8 to C9; Carbonyl Compounds; Esters

Methyl 2-chlorobenzoate Safety Profile

Hazard Codes: Xi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 24/25
S24/25:Avoid contact with skin and eyes.
Hazard Note of Benzoicacid, 2-chloro-, methyl ester (CAS NO.610-96-8): Irritant

Methyl 2-chlorobenzoate Specification

Benzoicacid, 2-chloro-, methyl ester (CAS NO.610-96-8), its Synonyms are Methyl 2-chlorobenzoate ; Methyl o-chlorobenzoate ; Methyl-2-chlorobenzoate ; Benzoic acid, o-chloro-, methyl ester (8CI) ; Methyl 2-chlorobenzoate .

Product Name

Methyl 2-chlorobenzoate

Synthetic route

Methyl 2-chlorobenzoate Chemical Properties

Methyl 2-chlorobenzoate Safety Profile

Methyl 2-chlorobenzoate Specification

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