Benzyl benzoate supplier | CasNO.120-51-4

Name
Benzyl benzoate
EINECS 204-402-9
CAS No. 120-51-4
Article Data862
CAS DataBase
Density 1.128 g/cm³
Solubility practically insoluble
Melting Point 18 °C
Formula C₁₄H₁₂O₂
Boiling Point 324.1 °C at 760 mmHg
Molecular Weight 212.248
Flash Point 147.9 °C
Transport Information
Appearance colourless oily liquid with pleasant aromatic odor
Safety 25
Risk Codes 22
Molecular Structure
Hazard Symbols Xn
Synonyms Benzylis benzoas;Peruscabina;Colebenz;Benzyl phenylformate;Benzoesaeurebenzylester;Peruscabin;Antiscabiosum;Ascabiol;Benzyl-benzoate;Benzyl benzoate (natural);Scabide;Ascabin;Benzyl alcohol benzoic ester;Benzyl benzenecarboxylate;Benylate;Vanzoate;Benzylum benzoicum;Benzylbenzenecarboxylate;Phenylmethyl benzoate;Venzonate;Scabagen;Scabanca;benzoic acid, phenylmethyl ester;Benzyl Benzoate , Natural;
PSA 26.30000
LogP 3.04360

Synthetic route

: 100-52-7
benzaldehyde

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
With [(ImDippN)Th{N(SiMe3)2}3] In benzene-d6 at 20℃; for 24h; Reagent/catalyst; Time;	100%
With lithium In hexane at 20℃; for 96h; Product distribution; Mechanism; Rate constant; concn. of title compd., reaction time varied; reaction at metal surface;	99%
With bis(1,5-cyclooctadiene)nickel(0); 1,3-bis-(2,6-diisopropylphenyl)-4,5-dichloroimidazol-2-ylidene In toluene at 23 - 60℃; Tishchenko reaction; Inert atmosphere;	99%

: 98-88-4
benzoyl chloride

: 100-51-6
benzyl alcohol

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
With bifunctional polymer In toluene at 20℃; for 6h;	100%
Stage #1: benzoyl chloride; benzyl alcohol In dichloromethane at 20℃; Stage #2: With poly{trans-bicyclo[2.2.1]hept-5-ene-2,3-di(chlorocarbonyl)} In dichloromethane Heating;	95%
With triethylamine	94%

: 65-85-0
benzoic acid

: 100-51-6
benzyl alcohol

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
With cyanomethylenetributyl-phosphorane In benzene at 100℃; for 24h;	100%
With TiO(acac)2 In xylene for 15h; Heating;	100%
With fluorosulfonyl fluoride; N-ethyl-N,N-diisopropylamine In 1,2-dichloro-ethane at 20℃; for 5h;	99%

: 93-58-3
benzoic acid methyl ester

: 100-51-6
benzyl alcohol

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
With 1,3-bis(3,5-bis(trifluoro-ethyl)phenyl)thiourea; 4-pyrrolidin-1-ylpyridine In octane for 24h; Reflux;	100%
With dilithium tetra(tert-butyl)zincate at 0℃; for 1h; Temperature; Inert atmosphere;	100%
With lanthanum(III) isopropoxide; 2-(2-methoxyethoxy)ethyl alcohol In hexane Reflux; chemoselective reaction;	97%

: 93-97-0
benzoic acid anhydride

: 100-51-6
benzyl alcohol

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
erbium(III) triflate In acetonitrile at 50℃; for 0.833333h;	100%
With bismuth(lll) trifluoromethanesulfonate In acetonitrile for 0.5h; Heating;	98%
With tris(pentafluorophenyl)borate In neat (no solvent) at 20℃; for 0.166667h; Green chemistry;	95%

: 100-44-7
benzyl chloride

: 65-85-0
benzoic acid

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
With triethylamine at 90℃; for 2h; Reagent/catalyst; Solvent; Ionic liquid;	100%
With triethylamine for 1h; Heating; Inert atmosphere; Ionic liquid;	99%
With caesium carbonate In acetonitrile for 0.5h; Heating;	90%

: 93-89-0
benzoic acid ethyl ester

: 100-51-6
benzyl alcohol

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
[Cl(C6F13C2H4)2SnOSn(C2H4C6F13)2Cl]2 In toluene at 150℃; for 16h;	100%
With 1,3-bis(2,6-diisopropylphenyl)imidazolylium-2-carboxylate at 120℃; for 3h; Inert atmosphere;	97%
With 1,3-bis(2,6-diisopropylphenyl)imidazolylium-2-carboxylate at 120℃; for 3h; Reagent/catalyst; Concentration; Inert atmosphere; Schlenk technique;	97%
With C16H25N3O2S In n-heptane for 48h; Reflux; Molecular sieve; Inert atmosphere;	92%

: 10002-30-9
S-pyridin-2-yl benzenecarbothioate

: 100-51-6
benzyl alcohol

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
tributylphosphine In dichloromethane at 20℃;	100%

: 21373-88-6, 16920-54-0
(PPh3)3CoH(N2)

: 1579-72-2
2,2,2-trifluoroethyl benzoate

A: 99668-73-2
(trifluoroethoxo)tris(triphenylphosphine)cobalt(I)

B: 120-51-4
benzoic acid benzyl ester

C: 7727-37-9
nitrogen

D: 1333-74-0
hydrogen

E: 71-43-2
benzene

Conditions

Conditions	Yield
In toluene PhCOOCH2CF3 added to toluene soln. of CoH(N2)(PPh3)3, evacuated, stirred at 20°C for 2 days;	A n/a B 28% C 100% D 17% E 32%

...Expand

: 582-25-2
Potassium benzoate

: benzyldiphenylsulfonium tetrafluoroborate

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
In acetonitrile at 20℃; for 7h;	99%

: 100-39-0
benzyl bromide

: 65-85-0
benzoic acid

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
With potassium fluoride; tetra(n-butyl)ammonium hydrogensulfate In tetrahydrofuran at 20℃; for 3h;	99%
With N-ethyl-N,N-diisopropylamine at 150℃; for 1h; Inert atmosphere; Neat (no solvent);	99%
With cesium fluoride In N,N-dimethyl-formamide at 10 - 15℃; for 24h;	98%

: 591-50-4
iodobenzene

: 201230-82-2
carbon monoxide

: 100-51-6
benzyl alcohol

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
With potassium hydroxide at 100℃; under 5171.62 Torr; for 6h; Autoclave;	99%
With triethylamine at 100℃; under 3750.38 Torr; for 1.5h; Inert atmosphere;	97%
With triethylamine at 100℃; under 3750.38 Torr; for 2h; Autoclave;	94%

...Expand

: 100-51-6
benzyl alcohol

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
With C39H31BMnNO2P2; potassium hydride at 150℃; for 24h;	99%
With C42H36ClIrO2P2; caesium carbonate In para-xylene for 36h; Inert atmosphere; Reflux;	98%
With oxygen; vanadia In toluene at 100℃; for 18h;	97%

: 769-78-8
vinyl benzoate

: 100-51-6
benzyl alcohol

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
With P(MeNCH2CH2)3N In tetrahydrofuran for 5.5h; Ambient temperature;	99%
With hexamethyltriamido-N-benzylimidophosphate In tetrahydrofuran at 20℃; for 14.5h; Acylation;	94%
With N,N'-bismesityl-imidazol-2-ylidene In tetrahydrofuran at 20℃; for 0.0833333h;	93%

: 2-benzoyl-1,3-dimethyl-1H-imidazol-3-ium trifluoromethanesulfonate

: 141556-42-5
[1,3-bis(2,4,6-trimethylphenyl)imidazol]-2-ylidene

: 100-46-9
benzylamine

: 100-51-6
benzyl alcohol

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
In tetrahydrofuran-d8 at 60℃;	99%

...Expand

: 2-benzoyl-1,3-dimethyl-1H-imidazol-3-ium trifluoromethanesulfonate

: 141556-42-5
[1,3-bis(2,4,6-trimethylphenyl)imidazol]-2-ylidene

: 100-51-6
benzyl alcohol

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
In tetrahydrofuran-d8 at 20℃; for 24h;	99%

...Expand

: 67460-10-0
2-Iodobenzoic acid,benzyl ester

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
With Ac-Cys-OMe; bismuth(III) oxide; N-ethyl-N,N-diisopropylamine In dichloromethane at 24℃; Irradiation;	99%
With tetraethylammonium perchlorate; triethylamine In ethanol; dimethyl sulfoxide at 20℃; for 12h; Solvent; Electrolysis; Green chemistry;	76%

: 22379-62-0
potassium benzyloxide

: 105769-58-2
C19H14N2O2

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
In tetrahydrofuran for 0.333333h; Ambient temperature;	98%

: 53772-44-4
benzyloxydiphenylphosphine

: 65-85-0
benzoic acid

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
With 2,6-dimethyl-1,4-benzoquinone In dichloromethane at 20℃; for 0.5h; Product distribution; Further Variations:; Reagents;	98%
With 2,6-dimethyl-1,4-benzoquinone In dichloromethane at 20℃; for 0.5h;	98%
With 2,6-dimethyl-1,4-benzoquinone In dichloromethane at 20℃; for 1h;
With p-benzoquinone In dichloromethane at 20℃; for 1h;

: 7007-15-0
3-benzoyl-1,3-oxazolidin-2-one

: 100-51-6
benzyl alcohol

A: 497-25-6
dimethylenecyclourethane

B: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
With samarium diiodide In tetrahydrofuran at 20℃; for 2h;	A n/a B 98%

...Expand

: 591-50-4
iodobenzene

: 100-51-6
benzyl alcohol

: 13939-06-5, 199620-15-0
molybdenum hexacarbonyl

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
In N,N-dimethyl-formamide at 25℃; for 48h; Reagent/catalyst; Irradiation; Green chemistry;	98%
With C35H20F34NO3(1-)Pd(2+)Cl(1-); N-ethyl-N,N-diisopropylamine In neat (no solvent) at 130℃; for 0.333333h; Microwave irradiation;	96%
With potassium phosphate; palladium diacetate; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene for 1.5h; Milling;	91%
With tributyl-amine In N,N-dimethyl-formamide at 80℃; for 4h;	82%

...Expand

: 103-50-4
dibenzyl ether

: 98-88-4
benzoyl chloride

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
With zinc(II) oxide In neat (no solvent) at 0 - 20℃; for 2.5h; Green chemistry;	98%

: 15082-42-5
lithium benzyloxide

: 105769-58-2
C19H14N2O2

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
In tetrahydrofuran Ambient temperature;	97%

: 451-40-1
phenyl benzyl ketone

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
With 3-chloro-benzenecarboperoxoic acid for 24h; Product distribution; Ambient temperature; in CHCl3;	97%
With 3-chloro-benzenecarboperoxoic acid for 24h; Ambient temperature;	97%
With oxygen; benzaldehyde In 1,2-dichloro-ethane at 30℃; for 18h; Baeyer-Villiger Ketone Oxidation;	65%

: 93-58-3
benzoic acid methyl ester

: 140-11-4
Benzyl acetate

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
With sodium 4-tert-butylphenolate; sodium t-butanolate In tetrahydrofuran	97%

: 343227-22-5
Adamantane-1-carboxylic acid cyclohexyl ester

: 100-51-6
benzyl alcohol

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
With Iron(III) isopropoxide; N-butylpyridinium bis(trifluoromethanesulfonyl)imide; zirconium(IV) tetraisopropoxide In toluene for 7h;	97%

: 120-46-7
1,3-diphenylpropanedione

: 100-51-6
benzyl alcohol

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
With iron(III) chloride at 80℃; for 16h; Retro-Claisen condensation; Neat (no solvent);	97%
With sodium t-butanolate In tert-Amyl alcohol at 120℃; for 18h; Claisen Condensation; Schlenk technique;	71%

: C14H15N2O(1+)*I(1-)

: 100-51-6
benzyl alcohol

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
With N-ethyl-N,N-diisopropylamine In dichloromethane at 20℃; for 2h;	97%

: 74542-54-4
N,N-phenyl-p-toluenesulfonylbenzamide

: 100-51-6
benzyl alcohol

: 120-51-4
benzoic acid benzyl ester

Conditions

Conditions	Yield
With cesium fluoride In acetonitrile at 100℃; for 15h; Catalytic behavior; Reagent/catalyst; Solvent; Temperature; Sealed tube;	97%

: 120-51-4
benzoic acid benzyl ester

: 65-85-0
benzoic acid

Conditions

Conditions	Yield
With hydrogen In methanol at 25℃; for 24h; Reagent/catalyst; Solvent; Temperature; chemoselective reaction;	100%
With hydrogen; palladium diacetate; pyrographite In tetrahydrofuran; methanol at 25℃; under 760.051 Torr; for 12h;	99%
With hydrogen; palladium diacetate; pyrographite In isopropyl alcohol at 25℃; under 760.051 Torr; for 14h;	99%

: 120-51-4
benzoic acid benzyl ester

: 100-51-6
benzyl alcohol

Conditions

Conditions	Yield
With C56H70Cl3N10Ru2(1+)*F6P(1-); potassium tert-butylate; hydrogen In tetrahydrofuran; dodecane at 70℃; under 37503.8 Torr; for 16h; Inert atmosphere; Glovebox; Autoclave;	100%
With dichloro(benzene)ruthenium(II) dimer; 2-((di-p-tolylphosphino)methyl)-1-methyl-1H-imidazole; potassium tert-butylate; hydrogen In tetrahydrofuran at 100℃; under 37503.8 Torr; for 2h;	99%
With C66H102N4OP2Ru; hydrogen In toluene at 105℃; under 22502.3 Torr; for 20h; Inert atmosphere; Glovebox;	99%

: 67-56-1
methanol

: 120-51-4
benzoic acid benzyl ester

: 93-58-3
benzoic acid methyl ester

Conditions

Conditions	Yield
With diethylamine; isopropyl alcohol; lithium bromide at 20℃; for 24h; neat (no solvent); chemoselective reaction;	99%
With potassium phosphate; N,N-didecyl-N,N-dimethylammonium bromide at 20℃; for 4.5h;	97%
With Merrifield resin-supported N3=P(MeNCH2CH2)3N at 23 - 25℃; for 5h; Inert atmosphere;	95%
In hexane at 39℃; for 168h; lipase from Pseudomonas fluorescens;	82.0 % Spectr.
With lipase from Pseudomonas fluorescens In hexane at 40℃; for 168h; Product distribution; convenient method for enzymatic benzyl-alkyl transesterification; other benzyl and dibenzyl esters, other aliphatic alcohols, or lipase from Candida cylindracea; influenc of reaction time and and alcohol concentration;

: 120-51-4
benzoic acid benzyl ester

: 95-55-6
2-amino-phenol

: 3743-70-2
N-(2-hydroxyphenyl)benzamide

Conditions

Conditions	Yield
With trimethylaluminum chloride In toluene for 24h; Heating;	99%

: 120-51-4
benzoic acid benzyl ester

: 25015-63-8
4,4,5,5-tetramethyl-[1,3,2]-dioxaboralane

: 95843-98-4
2-(benzyloxy)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Conditions

Conditions	Yield
With ToMMgMe at 24.84℃; for 0.5h;	99%
With C12H36MgN2Si4 In neat (no solvent) at 20℃; for 0.166667h; Catalytic behavior; Reagent/catalyst; Temperature; Solvent; Inert atmosphere; Schlenk technique;	99%
With 3C7H21Si3(1-)*La(3+) In benzene at 25℃; for 0.5h; Kinetics; Inert atmosphere;

: 120-51-4
benzoic acid benzyl ester

: 107-15-3
ethylenediamine

: 644-33-7
N,N'-ethanediyl-bis-benzamide

Conditions

Conditions	Yield
With carbonylhydrido(tetrahydroborato)[bis(2-diphenylphosphinoethyl)-amino]ruthenium(II); potassium tert-butylate In toluene at 120℃; for 48h; Inert atmosphere; Schlenk technique; Reflux; Green chemistry;	98%

: 120-51-4
benzoic acid benzyl ester

: 108-67-8
1,3,5-trimethyl-benzene

: 954-16-5
2,4,6-Trimethylbenzophenon

Conditions

Conditions	Yield
With iodine; phosphorus trichloride In acetonitrile at 160℃; Sealed tube; Schlenk technique;	98%

Benzyl benzoate Chemical Properties

Molecular structure of Benzyl benzoate (CAS NO.120-51-4) is:

Product Name: Benzyl benzoate
CAS Registry Number: 120-51-4
IUPAC Name: Benzyl benzoate
Molecular Weight: 212.24388 [g/mol]
Molecular Formula: C₁₄H₁₂O₂
XLogP3: 4
H-Bond Donor: 0
H-Bond Acceptor: 2
EINECS: 204-402-9
Melting Point: 18 °C
Surface Tension: 44 dyne/cm
Density: 1.128 g/cm³
Flash Point: 147.9 °C
Enthalpy of Vaporization: 56.61 kJ/mol
Boiling Point: 324.1 °C at 760 mmHg
Vapour Pressure: 0.00025 mmHg at 25°C
Water Solubility: practically insoluble
Stability: Stable. Substances to be avoided include strong oxidizing agents. Combustible.

Benzyl benzoate Uses

Benzyl benzoate (CAS NO.120-51-4) may be used as an antiparasitic insecticide to kill the mites and lice responsible for the skin condition scabies. Also it can be used as a food additive in artificial flavors, a treatment for sweet itch in horses, a solvent for various chemical reactions, a solvent for various chemical reactions, a fixative in fragrances to improve the stability and other characteristics of the main ingredients.

Benzyl benzoate Production

Benzyl benzoate can be generated from benzaldehyde by the Tishchenko reaction.

Benzyl benzoate Safety Profile

Hazard Codes: Harmful Xn
Risk Statements: 22
R22:Harmful if swallowed.
Safety Statements: 25
S25:Avoid contact with eyes.
WGK Germany: 2
RTECS: DG4200000
HS Code: 29163100

Benzyl benzoate Specification

Benzyl benzoate , its cas register number is 120-51-4. It also can be called Benylate ; Benzoic acid, benzyl ester ; Benzoic acid, phenylmethyl ester ; Phenylmethyl benzoate ; Novoscabin ; Peruscabin ; Peruscabina ; Scabagen ; Scabanca ; Scabide ; Scabiozon ; Scabitox ; Scobenol ; Spasmodin .It is a colourless oily liquid with pleasant aromatic odor.

Product Name

Benzyl benzoate

Synthetic route

Benzyl benzoate Chemical Properties

Benzyl benzoate Uses

Benzyl benzoate Production

Benzyl benzoate Safety Profile

Benzyl benzoate Specification

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