Tetrabutylammoniumchloride supplier

Name
Tetrabutyl ammonium chloride
EINECS 214-195-7
CAS No. 1112-67-0
Article Data21
CAS DataBase
Density 0.98
Solubility soluble in water
Melting Point 83-86 °C
Formula C₁₆H₃₆ClN
Boiling Point
Molecular Weight 277.922
Flash Point >110°C
Transport Information
Appearance white crystals, granules or powder
Safety 26-37/39-36
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 1-Butanaminium,N,N,N-tributyl-, chloride (9CI);Ammonium, tetrabutyl-, chloride (8CI);Tetrabutylammonium chloride (6CI);N,N,N-Tributyl-1-butanaminium chloride;TBAC 100;Tetra-n-butylammonium chloride;1-Butanaminium, N,N,N-tributyl-, chloride;1-Butanaminium, N,N,N-tributyl-, chloride (1:1);N,N,N-Tributyl-1-butanaminium chloride;N,N,N-Tributylbutan-1-aminium chloride;Tetrabutylammonium Chloride;
PSA 0.00000
LogP 2.00760

Synthetic route

: bis(tetra-n-butylammonium) trans-dioxotetracyanoosmate(VI)

: 75-57-0
tetramethlyammonium chloride

: tetramethyl-ammonium trans-dioxotetracyanoosmate(VI)

B: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
In ethanol; dichloromethane soln. of NMe4Cl in EtOH added to a soln. of (n-Bu4N)2(OsO2(CN)4) in CH2Cl2; pptd. Os complex recrystd. from CH3CN;	A 80% B n/a

...Expand

: tetrabutylammonium trans-(18)O-dioxotetracyanoosmate(VI)

: 75-57-0
tetramethlyammonium chloride

: tetramethyl-ammonium trans-(18)O-dioxotetracyanoosmate(VI)

B: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
In ethanol; dichloromethane soln. of Me4NCl in EtOH added to a soln. of (n-Bu4N)2(Os(18)O2(CN)4) in CH2Cl2; pptd. Os complex recrystd. from CH3CN;	A 70% B n/a

...Expand

: {N(C4H9)4}(1+)*{Mo3OCl6(OCOCH3)3}(1-)*CH3COCH3={N(C4H9)4}{Mo3OCl6(OCOCH3)3}*CH3COCH3

: 594-09-2
trimethylphosphane

A: {Mo3OCl4(OCOCH3)3(P(CH3)3)2}

B: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
With Zn In tetrahydrofuran mixture of Mo-compound, Zn metal dust and trimethylphosphine was stirred at room temp. in THF under Ar for 36 h; filtn., the ppt. was treated with acetone, filtn., the filtrate was layered with hexane, crystn. after several days of standing;	A 63% B n/a

...Expand

: 76634-95-2
3-chloro-2-(trimethylsilyloxy)prop-1-ene

: tetrabutylammonium tricarbonylnitrosylferrate

A: (η3-2-trimethylsiloxyallyl)(carbonyl)2nitrosyliron

B: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
In dichloromethane byproducts: CO; Stirring of mixt. at room temp. for 2 h, during this period, one molar equiv. of CO to TBAFe evolved; Evapn. in vac., chromy. (silica gel, pentane).;	A 57% B n/a

...Expand

: 2052-49-5
tetra(n-butyl)ammonium hydroxide

: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
With hydrogenchloride In methanol; water	57%
With [(Cy3P)2Pd(Cl)Ph]; water In tetrahydrofuran at 20℃; Equilibrium constant; Inert atmosphere; Sealed vial;

: tetrabutylammonium trans-dioxo-(13C)-tetracyanoosmate(VI)

: 75-57-0
tetramethlyammonium chloride

: tetramethylammonium trans-dioxo-(13)C-tetracyanoosmate(VI)

B: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
In ethanol; dichloromethane soln. of Me4NCl in EtOH added to a soln. of (n-Bu4N)2(OsO2((13)CN)4) in CH2Cl2; pptd. Os complex isolated;	A 50% B n/a

...Expand

: 111697-70-2
1,3-dichloro-2-trimethylsiloxy-1-propene

: tetrabutylammonium tricarbonylnitrosylferrate

A: (CHClC(OSi(CH3)3)CH2)Fe(CO)2NO

B: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
In dichloromethane byproducts: CO; Stirring of mixt. at room temp. for 2 h.; Evapn. in vac., chromy. (silica gel, pentane).;	A 37% B n/a

...Expand

: 1923-70-2
tetrabutylammonium perchlorate

: 554-68-7
triethylamine hydrochloride

A: 1112-67-0
tetrabutyl-ammonium chloride

B: 14999-75-8
Triethylammonium perchlorate

Conditions

Conditions	Yield
In chloroform at 25℃; Equilibrium constant;

...Expand

: 3002-48-0
tetra-n-butylammonium p-nitrophenoxide

A: 1112-67-0
tetrabutyl-ammonium chloride

B: 1,2,3,4,5,6,8-Heptachloro-7-(4-nitro-phenoxy)-[1,3,5,7,2,4,6,8]tetrazatetraphosphocane

Conditions

Conditions	Yield
With octachlorocyclotetraphosphazene In chloroform at 24.9℃; Rate constant; var. solvents;

: 3002-49-1
tetrabutylammonium 2,4-dinitrophenolate

A: 1112-67-0
tetrabutyl-ammonium chloride

B: 1,2,3,4,6-Pentachloro-5-(2,4-dinitro-phenoxy)-[1,3,5,2,4,6]triazatriphosphinane

Conditions

Conditions	Yield
With 2,2,4,4,6,6-hexachloro-1,3,5-triaza-2,4,6-triphosphorine In chloroform at 24.9℃; Rate constant; var. solvents;

: 3002-49-1
tetrabutylammonium 2,4-dinitrophenolate

A: 1112-67-0
tetrabutyl-ammonium chloride

B: 157033-41-5
2,2,4,4,6-Pentachloro-6-(2,4-dinitro-phenoxy)-2λ5,4λ5,6λ5-[1,3,5,2,4,6]triazatriphosphinine

Conditions

Conditions	Yield
With 2,2,4,4,6,6-hexachloro-1,3,5-triaza-2,4,6-triphosphorine; 4-nitro-phenol; buffer pH 9.18 In chlorobenzene at 24.9℃; Rate constant; Equilibrium constant; other proton donors, var. pH;

: C16H36N(1+)*C7H11O3(1-)

A: 609-14-3
2-acetylpropanoic acid ethyl ester

B: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
lithium fluoride at 20℃; Rate constant; Equilibrium constant; other salts as catalysts;

: tetra(n-butyl)ammonium 2-hydroxy-5-nitrotoluene-α-sulphonyl chloride

A: 14618-10-1
5-Nitrobenz<1,6-d>-3H-1,2-oxathiole S,S-dioxide

B: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
In nitrobenzene Equilibrium constant; other solvent;

: C16H36N(1+)*C20H24N4S2*Cl(1-)

A: 1013937-44-4
N,N''-cis-1,2-cyclohexanediylbis[N'-phenylthiourea]

B: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
In dimethylsulfoxide-d6 Equilibrium constant; Further Variations:; Solvents;

: C16H36N(1+)*C22H22N4S2*Cl(1-)

A: 37042-64-1
C22H22N4S2

B: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
In dimethylsulfoxide-d6 Equilibrium constant;

: C16H36N(1+)*C26H24N4S2*Cl(1-)

A: 1013937-45-5
C26H24N4S2

B: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
In dimethylsulfoxide-d6 Equilibrium constant;

: C16H36N(1+)*C31H26F6N4S2*Cl(1-)

A: 1013937-46-6
C31H26F6N4S2

B: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
In dimethylsulfoxide-d6 Equilibrium constant;

: C16H36N(1+)*C36H48N6O4S2*Cl(1-)

A: 1013937-48-8
C36H48N6O4S2

B: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
In dimethylsulfoxide-d6 Equilibrium constant;

: potassium chloride

: 1643-19-2
tetrabutylammomium bromide

A: 1112-67-0
tetrabutyl-ammonium chloride

B: 7558-02-3
potassium bromide

Conditions

Conditions	Yield
In toluene Kinetics; no ion exchange between solid KCl and Bu4NBr in toluene (50-105°C);	A 0% B 0%

...Expand

: 116882-28-1
carbonato{2,2'-bipyridyl}{1,2-bis(diphenylphosphino)ethano}osmium(II)

: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
With hydrogenchloride In acetone	>99

: bis(tetra-n-butylammonium)hexachlorotitanate(IV)

: 125876-20-2
tetra-n-butylammonium tetrachlorobis(tetrahydrofuran)titanate(III) tetrahydrofuran

B: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
In tetrahydrofuran byproducts: HCl, C4H7OCl; Irradiation (UV/VIS); N2 atmosphere; influence of light (1 month);

: C16H36N(1+)*C29H42F3N5O2S*Cl(1-)

A: 1195974-31-2
1-(2-((S)-2-(3-((1R,2R)-2-(2,5-dimethyl-1H-pyrrol-1-yl)cyclohexyl)thioureido)-3,3-dimethylbutoxy)-5-(trifluoromethyl)phenyl)-3-ethylurea

B: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
In chloroform-d1 at -15℃; Equilibrium constant;

: C16H36N(1+)*C26H36F3N3OS*Cl(1-)

A: 1195974-41-4
1-((S)-3,3-dimethyl-1-(4-(trifluoromethyl)phenoxy)butan-2-yl)-3-((1R,2R)-2-(2,5-dimethyl-1Hpyrrol-1-yl)cyclohexyl)thiourea

B: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
In chloroform-d1 at -15℃; Equilibrium constant;

: 1242065-15-1
C16H36N(1+)*C30H33N3O12*Cl(1-)

A: 1242065-09-3
C30H33N3O12

B: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
In [D3]acetonitrile at 23℃; Equilibrium constant;

: 1186217-02-6
C16H36N(1+)*C72H72N4O9*Cl(1-)

A: 1186216-97-6
C72H72N4O9

B: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
In dimethylsulfoxide-d6; [D3]acetonitrile at 24.84℃; Equilibrium constant;

: 1186217-03-7
C16H36N(1+)*C36H48N4O9*Cl(1-)

A: 1186216-98-7
C36H48N4O9

B: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
In dimethylsulfoxide-d6; [D3]acetonitrile at 24.84℃; Equilibrium constant;

: C12H24N4O3*C16H36N(1+)*Cl(1-)

A: 1112-67-0
tetrabutyl-ammonium chloride

B: 124764-08-5
N,N',N''-(nitrilotris(ethane-2,1-diyl))triacetamide

Conditions

Conditions	Yield
In dimethylsulfoxide-d6; [D3]acetonitrile at 24.84℃; Equilibrium constant;

: 1186217-04-8
C16H36N(1+)*C21H42N4O3*Cl(1-)

A: 1186217-01-5
C21H42N4O3

B: 1112-67-0
tetrabutyl-ammonium chloride

Conditions

Conditions	Yield
In dimethylsulfoxide-d6; [D3]acetonitrile at 24.84℃; Equilibrium constant;

: 1186217-05-9
C16H36N(1+)*C27H54N4O3*Cl(1-)

A: 1112-67-0
tetrabutyl-ammonium chloride

B: 239116-99-5
heptanoic acid {2-[bis-(2-heptanoylamino-ethyl)-amino]-ethyl}-amide

Conditions

Conditions	Yield
In dimethylsulfoxide-d6; [D3]acetonitrile at 24.84℃; Equilibrium constant;

: 1112-67-0
tetrabutyl-ammonium chloride

: 148305-65-1, 148305-68-4, 148305-70-8
tetra-n-butyl-ammonium dihydrogentrifluoride

Conditions

Conditions	Yield
With potassium hydrogen bifluoride In dichloromethane for 0.5h; Ambient temperature;	100%

: 1112-67-0
tetrabutyl-ammonium chloride

: 930-69-8
sodium thiophenolate

: 4670-62-6
tetra-N-butylammonium benzenethiolate

Conditions

Conditions	Yield
In tetrahydrofuran for 4h; Inert atmosphere;	100%

: 1112-67-0
tetrabutyl-ammonium chloride

: 286471-91-8
phosphonocrotonate

: phosphono crotonic acid tri-(tetrabutyl ammonium) salt

Conditions

Conditions	Yield
In diethyl ether; water pH=7; Addition;	100%

: 1112-67-0
tetrabutyl-ammonium chloride

: 7782-50-5
chlorine

: 7440-57-5, 457905-15-6
gold

: 17769-64-1
tetra-n-butylammonium tetrachloroaurate(III)

Conditions

Conditions	Yield
In ethanol bubbling of Cl2 into suspn. of gold in soln. of Bu4NBr (in dark, with stirring), warming 60 - 70°C; decantation and cooling to 0°C, crystn.; elem. anal.;	100%

...Expand

: 1112-67-0
tetrabutyl-ammonium chloride

: 70197-13-6
methyltrioxorhenium(VII)

: {bis(tetra(n-butyl)ammonium)}{(dichloro)methyltrioxorhenate(VII)}

Conditions

Conditions	Yield
In diethyl ether addn. of NBu4Cl to a soln. of MeReO3 at room temp.; after 10 min solvent removed, washed the residue with ether, drying in vac.; elem. anal.;	100%

: 671821-32-2
(C2H5)3NH(1+)*(CH3N(CH2CH2NC6F5)2)MoCl3(1-)=((C2H5)3NH)((CH3N(CH2CH2NC6F5)2)MoCl3)

: 1112-67-0
tetrabutyl-ammonium chloride

: 282726-71-0
(C4H9)4N(1+)*(CH3N(CH2CH2NC6F5)2)MoCl3(1-)=((C4H9)4N)((CH3N(CH2CH2NC6F5)2)MoCl3)

Conditions

Conditions	Yield
In tetrahydrofuran	100%
In tetrahydrofuran byproducts: Et3NHCl; under N2; Bu4NCl (1.1 equiv.) added to soln. of Mo complex in THF; stirred for 12 h; filtered through Celite; volatiles removed from filtrate in vac.; dissolved in toluene; filtered; vol. of filtrate reduced in vac.; added dropwise to rapidly stirred pentane; ppt. collected on frit; washed with pentane; dried in vac.; elem. anal.;	98%

: 202645-79-2
iodophthalocyaninato(2-)thallium(III)

: 1112-67-0
tetrabutyl-ammonium chloride

: tetra(n-butyl)ammonium cis-dichlorophthalocyaninato(2-)thalate(III)*0.5(C2H5)2O

Conditions

Conditions	Yield
In dichloromethane stirring (1 h, room temp.); filtn., addn. of Et2O, crystn. (24 h), washing (acetone/Et2O 1:3, Et2O),drying (vac.);	100%

: 71870-09-2
(tetrahydrofuran)(carbonyl)phthalocyaninato(2-)osmium(II)

: 1112-67-0
tetrabutyl-ammonium chloride

: 186336-60-7
N(C4H9)4(1+)*[Os(CO)(Cl)(C6H4C2N2)4](1-)=[N(C4H9)4][Os(CO)Cl(C6H4C2N2)4]

Conditions

Conditions	Yield
In tetrahydrofuran 1 h, 293+/-2 K; addn. of n-pentane, washing (H2O), drying (vac.); elem. anal.;	100%

: potassiumhexacyanoferrate(II) trihydrate

: 1066-45-1
trimethyltin(IV)chloride

: 1112-67-0
tetrabutyl-ammonium chloride

: .

Conditions

Conditions	Yield
In water byproducts: KCl;	100%

...Expand

: di(aqua)phthalocyaninato(2-)chromium(III) iodide *3H2O

: 1112-67-0
tetrabutyl-ammonium chloride

: N(C4H9)4(1+)*[CrCl2(C6H4N2C2)4](1-)*H2O=[N(C4H9)4][CrCl2(C6H4N2C2)4]*H2O

Conditions

Conditions	Yield
In acetone refluxing (5 min), pptn.; centrifugation, washing (acetone/Et2O 1/3), drying (vac., over KOH); elem. anal.;	100%

: 575456-04-1
Fe(3,6,13,17-tetraethyl-2,7,12,18-tetramethylhemiporphycene)I

: 1112-67-0
tetrabutyl-ammonium chloride

: 575456-02-9
Fe(3,6,13,17-tetraethyl-2,7,12,18-tetramethylhemiporphycene)Cl

Conditions

Conditions	Yield
In not given 1 equivalent of nBu4NCl added;	100%

: 1112-67-0
tetrabutyl-ammonium chloride

: 127-08-2
potassium acetate

: 10534-59-5
tetrabutylammonium acetate

Conditions

Conditions	Yield
In methanol	100%
In methanol for 24h; Inert atmosphere;
In methanol for 24h; Inert atmosphere;

: 1112-67-0
tetrabutyl-ammonium chloride

: 2388-10-5
lithium isopropoxide

: 851848-96-9
C16H36N(1+)*C3H7O(1-)

Conditions

Conditions	Yield
In dichloromethane at 20℃; for 18h; Inert atmosphere;	100%

: C18H14O6

: 1112-67-0
tetrabutyl-ammonium chloride

: 67-64-1
acetone

: 2C18H14O6*2C16H36N(1+)*2Cl(1-)*C3H6O

Conditions

Conditions	Yield
In diethyl ether; water	100%

...Expand

: {Ru(2,2'-bipyrimidine)(2,2'-bipyrazine)2}(PF6)2

: 1112-67-0
tetrabutyl-ammonium chloride

: [RuII(2,2′-bipyrazyl)2(2,2′-bipyrimidine)]Cl2

Conditions

Conditions	Yield
In acetone	100%

: [RuII(2,2′-bipyrazyl)2(N″,N′″-dimethyl-4,4′:2′,2″:4″,4′″-quaterpyridinium)](hexafluorophosphate)4

: 1112-67-0
tetrabutyl-ammonium chloride

: [RuII(2,2′-bipyrazyl)2(N″,N′″-dimethyl-4,4′:2′,2″:4″,4′″-quaterpyridinium)]Cl4

Conditions

Conditions	Yield
In acetone	100%

: [RuII(2,2′-bipyrazyl)2(4,4′-dimethyl-2,2′-bipyridyl)](PF6)2

: 1112-67-0
tetrabutyl-ammonium chloride

: [RuII(2,2′-bipyrazyl)2(4,4′-dimethyl-2,2′-bipyridyl)]Cl2

Conditions

Conditions	Yield
In acetone	100%

: [RuII(2,2′-bipyrazyl)2(4,4′-bis(tert-butyl)-2,2′-bipyridyl)](PF6)2

: 1112-67-0
tetrabutyl-ammonium chloride

: [RuII(2,2′-bipyrazyl)2(4,4′-bis(tert-butyl)-2,2′-bipyridyl)]Cl2

Conditions

Conditions	Yield
In acetone	100%

: [RuII(bipyrazyl)2(4,4′-diphenyl-2,2′-bipyridyl)](PF6)2

: 1112-67-0
tetrabutyl-ammonium chloride

: [RuII(bipyrazyl)2(4,4′-diphenyl-2,2′-bipyridyl)]Cl2

Conditions

Conditions	Yield
In acetone	100%

: [RuII(2,2′-bipyrazyl)2(4,4′-dichloro-2,2′-bipyridyl)](PF6)2

: 1112-67-0
tetrabutyl-ammonium chloride

: [RuII(2,2′-bipyrazyl)2(4,4′-dichloro-2,2′-bipyridyl)]Cl2

Conditions

Conditions	Yield
In acetone	100%

: [RuII(2,2′-bipyrazyl)2(4,4′-diamino-2,2′-bipyridyl)](PF6)2

: 1112-67-0
tetrabutyl-ammonium chloride

: [RuII(2,2′-bipyrazyl)2(4,4′-diamino-2,2′-bipyridyl)]Cl2

Conditions

Conditions	Yield
In acetone	100%

: 2,2'-bipyridyl-bis(2,2'-bipyrazinyl)ruthenium(II) hexafluorophosphate

: 1112-67-0
tetrabutyl-ammonium chloride

: [RuII(2,2′-bipyrazyl)2(2,2′-bipyridyl)]Cl2

Conditions

Conditions	Yield
In acetone	100%

: [RuII(2,2′-bipyrazyl)2(4,4′-bis(trifluoromethyl)-2,2′-bipyridyl)](PF6)2

: 1112-67-0
tetrabutyl-ammonium chloride

: [RuII(2,2′-bipyrazyl)2(4,4′-bis(trifluoromethyl)-2,2′-bipyridyl)]Cl2

Conditions

Conditions	Yield
In acetone	100%

: [RuII(2,2′-bipyrazyl)2(4,4′-bis(methoxycarbonyl)-2,2′-bipyridyl)](PF6)2

: 1112-67-0
tetrabutyl-ammonium chloride

: [RuII(2,2′-bipyrazyl)2(4,4′-bis(methoxycarbonyl)-2,2′-bipyridyl)]Cl2

Conditions

Conditions	Yield
In acetone	100%

: C32H28IrN6(3+)*3F6P(1-)

: 1112-67-0
tetrabutyl-ammonium chloride

: 7732-18-5
water

: C32H28IrN6(3+)*3Cl(1-)*2.5H2O

Conditions

Conditions	Yield
In acetone	100%

...Expand

: C34H26F6IrN6(3+)*3F6P(1-)

: 1112-67-0
tetrabutyl-ammonium chloride

: 7732-18-5
water

: C34H26F6IrN6(3+)*3Cl(1-)*2.5H2O

Conditions

Conditions	Yield
In acetone	100%

...Expand

: C40H44IrN6(3+)*3F6P(1-)

: 1112-67-0
tetrabutyl-ammonium chloride

: 7732-18-5
water

: C40H44IrN6(3+)*3Cl(1-)*2.5H2O

Conditions

Conditions	Yield
In acetone	100%

...Expand

: [IrIII(2,2′-C^N)2(2,2'-bipyridyl)][PF6]3*H2O

: 1112-67-0
tetrabutyl-ammonium chloride

: [IrIII(2,2′-C^N)2(2,2'-bipyridyl)]Cl3*4H2O

Conditions

Conditions	Yield
In acetone	100%

: 2,5,8-tri(4-pyridyl)1,3-diazaphenalene

: 1112-67-0
tetrabutyl-ammonium chloride

: tetrabutylammonium 2,5,8-tri(4-pyridyl)-1,3-diazaphenalenolate

Conditions

Conditions	Yield
Stage #1: 2,5,8-tri(4-pyridyl)1,3-diazaphenalene With sodium methylate In methanol at 20℃; for 0.5h; Inert atmosphere; Stage #2: tetrabutyl-ammonium chloride In methanol at 20℃; for 0.5h; Inert atmosphere;	100%

: [{Ru(N,N'-dimethyl-2,11-diaza[3.3](2,6)-pyridinophane)}2(μ-1,6,7,12-tetraazaperylene)](PF6)4

: 1112-67-0
tetrabutyl-ammonium chloride

: C48H48N12Ru2(4+)*4Cl(1-)

Conditions

Conditions	Yield
In acetone Inert atmosphere;	100%

Tetrabutylammoniumchloride Specification

The 1-Butanaminium, N,N,N-tributyl-, chloride (1:1), with the CAS registry number 1112-67-0 and EINECS registry number 214-195-7, has the systematic name of N,N,N-tributylbutan-1-aminium chloride. And the molecular formula of this chemical is C₁₆H₃₆ClN. It is a kind of light sensitive white crystals, granules or powder, and should be stored under Nitrogen. In addition, it is used as Ion-pair chromatography reagent and phase transfer catalyst.

The physical properties of 1-Butanaminium, N,N,N-tributyl-, chloride (1:1) are as following: (1)ACD/LogP: -1.72; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.72; (4)ACD/LogD (pH 7.4): -1.72; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 2.78; (8)ACD/KOC (pH 7.4): 2.78; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 12; (12)Polar Surface Area: 0 Å².

Uses of 1-Butanaminium, N,N,N-tributyl-, chloride (1:1): It can react with 4-phosphono-but-2-enoic acid to produce phosphono crotonic acid tri(tetrabutylammonium) salt. This reaction will need solvent diethyl ether and H₂O, and PH 7. And the yield is about 100%.

1-Butanaminium, N,N,N-tributyl-, chloride (1:1) can react with 4-phosphono-but-2-enoic acid to produce phosphono crotonic acid tri(tetrabutylammonium) salt

You should be cautious while dealing with this chemical. It irritates eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection, and in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice

You can still convert the following datas into molecular structure:
(1)SMILES: [Cl-].CCCC[N+](CCCC)(CCCC)CCCC
(2)InChI: InChI=1/C16H36N.ClH/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;/h5-16H2,1-4H3;1H/q+1;/p-1
(3)InChIKey: NHGXDBSUJJNIRV-REWHXWOFAB

Product Name

Tetrabutyl ammonium chloride

Synthetic route

Tetrabutylammoniumchloride Specification

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