Copper,bromotris(triphenylphosphine)-, (T-4)- supplier

Name
BROMOTRIS(TRIPHENYLPHOSPHINE)COPPER(I)&
EINECS
CAS No. 15709-74-7
Article Data17
CAS DataBase
Density
Solubility
Melting Point 168-170 °C(lit.)
Formula C₅₄H₄₅BrCuP₃
Boiling Point 360 °C at 760 mmHg
Molecular Weight 930.323
Flash Point 181.7 °C
Transport Information
Appearance
Safety 22-24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Copper,bromotris(triphenylphosphine)- (7CI,8CI);Bromotris(triphenylphosphine)copper;Bromocopper-triphenylphosphane (1:3);Bromotris(triphenylphosphine)copper(I);
PSA 40.77000
LogP 11.17750

Synthetic route

: 603-35-0
triphenylphosphine

: 7789-45-9
copper(ll) bromide

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

Conditions

Conditions	Yield
In methanol for 0.5h; Heating / reflux;	93%
In methanol for 0.5h; Heating / reflux;	93%
In acetone to soln. of bromide in hot acetone soln. of triphenylphosphine in hot acetone added dropwise with stirring, refluxed for several h; filterd, washed with petroleum ether, dried for several h in vac.; elem.anal.;	34%

: 603-35-0
triphenylphosphine

: 7787-70-4
copper(I) bromide

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

Conditions

Conditions	Yield
In methanol for 4 - 5h;	90%
In methanol for 0.5h; Reflux;	87%
In acetonitrile at 80℃; for 1h; Inert atmosphere;	71%
In chloroform pptd. from CHCl3 soln. of stoich. amt. of CuBr and PPh3; according to P.F. Barron et al., J. Chem. Soc., Dalton Trans., 1987, 1099 and G. Costa , E. Reisenhofer and L. Stefani, J. Inorg. Nucl. Chem., 1965, 27, 2581;
In methanol at 60℃; for 0.166667h;	1.18 g

: BrCu*(x)H2O

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

Conditions

Conditions	Yield
With triphenylphosphine In methanol copper halogenide : triphenylphosphine = 1 : 3.5, intensive stirring; suction and drying in high vac., elem. anal.;

: 7787-70-4
copper(I) bromide

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

Conditions

Conditions	Yield
With triphenylphosphine In dichloromethane stoich. amts. Ph3P and CuBr mixed in small volume methylene chloride; pentane, hexane or cyclohexane added until ppt. began to form, soln. cooled in ice bath and allowed to stand for a few minutes and filtered;
With triphenyl phosphine In chloroform Stoicheiometric quantities of reagents were refluxed for 2-4 h in CHCl3;; the hot soln. was filtered, slow cooling and evapd.;;

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: 2010-15-3
3-phenyl-2-thioxoimidazolidin-4-one

: 144886-62-4
{Cu(P(C6H5)3)2(C6H5NC(O)CH2NHC(S))Br}

Conditions

Conditions	Yield
In benzene byproducts: triphenylphosphine; addn. of ligand to Cu complex soln.; refluxing, 2h; cooling; filtration; evapn. to half the volume; addn. of petroleum ether; standing, 2-3h; pptn.; centrifuging; washing (petroleum ether); drying (vac.); elem. anal.;	96%

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: 63400-51-1
bis(1,2,4-triazol-1-yl)methane

: 166662-57-3
[(P(C6H5)3)Cu(C5H6N6)Br]

Conditions

Conditions	Yield
In acetone byproducts: Ph3P; stirring; elem. anal.;	96%

: 15093-54-6
N-phenyl-1-morpholinethiocarbamide

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: 144886-68-0
{Cu(P(C6H5)3)2(C6H5NHC(S)N(CH2CH2)2O)Br}

Conditions

Conditions	Yield
In benzene byproducts: triphenylphosphine; addn. of ligand to Cu complex soln.; refluxing, 2h; cooling; filtration; evapn. to half the volume; addn. of petroleum ether; standing, 2-3h; pptn.; centrifuging; washing (petroleum ether); drying (vac.); elem. anal.;	90%

: 66-71-7
1,10-Phenanthroline

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: 25753-84-8
(1,10-phenanthroline)(triphenylphosphine)CuBr

Conditions

Conditions	Yield
In chloroform	90%
In chloroform at 20℃; for 0.166667h;	90%
In chloroform at 20℃; for 0.5h;	75%
In chloroform at 20℃; for 0.5h;	75%
In dichloromethane for 2h; Inert atmosphere;

: 253-72-5
1,6-naphthyridine

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: [CuBr(PPh3)2(4-Mepy)]

Conditions

Conditions	Yield
In chloroform	89%

: 288-13-1
NH-pyrazole

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: 166662-78-8
[(P(C6H5)3)2Cu(C3H4N2)Br]

Conditions

Conditions	Yield
In diethyl ether byproducts: Ph3P; stirring (6 h); elem. anal.;	88%

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: 27258-04-4
bis(pyrazol-1-yl)methane

: 166662-56-2
[(P(C6H5)3)Cu(C7H8N4)Br]

Conditions

Conditions	Yield
In diethyl ether byproducts: Ph3P; stirring (6 h); elem. anal.;	87%

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: 705-62-4
N,N-dimethyl-N'-phenylthiourea

: 144749-75-7
{Cu(P(C6H5)3)2(C6H5NHC(S)N(CH3)2)Br}

Conditions

Conditions	Yield
In benzene slow addn. of ligand soln. to soln. of Cu-complex, refluxing (2 h); concg. in vac., addn. of petroleum ether (60-80°C), standing (2-3 h), centrifugation, washing (petroleum ether), drying in vac., elem. anal.;	86%

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: 15093-47-7
1,1-dibutyl-3-phenylthiourea

: 144749-78-0
bromo(N,N-dibutyl-N'-phenylthiourea-S)bis(triphenylphosphine-P)copper(I)

Conditions

Conditions	Yield
In benzene slow addn. of ligand soln. to soln. of Cu-complex, refluxing (2 h); concg. in vac., addn. of petroleum ether (60-80°C), standing (2-3 h), centrifugation, washing (petroleum ether), drying in vac., elem. anal.;	86%

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: 86-93-1
1-Phenyl-1H-tetrazole-5-thiol

: 144886-65-7
CuBr(triphenylphosphane)2(1-phenyl-1H-tetrazole-5(4H)-thione)

Conditions

Conditions	Yield
In benzene byproducts: triphenylphosphine; addn. of ligand to Cu complex soln.; refluxing, 2h; cooling; filtration; evapn. to half the volume; addn. of petroleum ether; standing, 2-3h; pptn.; centrifuging; washing (petroleum ether); drying (vac.); elem. anal.;	85%

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: 1422766-85-5
diethyl (1,10-phenanthrolin-4-yl)phosphonate

: CuI(diethyl (1,10-phenanthrolin-4-yl)phosphonate)(triphenylphosphine)bromide

Conditions

Conditions	Yield
In chloroform at 20℃; for 0.166667h;	82%

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: N-[(5-chloro-2-nitrophenyl)carbamothioyl]pentanamide

: {N-[(5-chloro-2-nitrophenyl)carbamothioyl]pentanamide}[bis(triphenylphosphine)]copper(I) bromide

Conditions

Conditions	Yield
In methanol; dichloromethane for 5 - 6h;	79%

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: N-[(4-methyl-2-nitrophenyl)carbamothioyl]butanamide

: {N-[(4-methyl-2-nitrophenyl)carbamothioyl]-butanamide}[bis(triphenylphosphine)]copper(I)bromide

Conditions

Conditions	Yield
In methanol; dichloromethane for 5 - 6h;	78%

: 134469-06-0
thiazolidine-2-thione

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: 122201-83-6
copper(I)(1,3-thiazolidine-2-thione)-bis(triphenylphosphine) bromide

Conditions

Conditions	Yield
In benzene slow addn. of ligand soln. to soln. of Cu-complex, refluxing (2 h); concg. in vac., addn. of petroleum ether (60-80°C), standing (2-3 h), centrifugation, washing (petroleum ether), drying in vac., elem. anal.;	77%

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: 1422766-81-1
diethyl (1,10-phenanthrolin-5-yl)phosphonate

: C34H32BrCuN2O3P2

Conditions

Conditions	Yield
In chloroform at 20℃; for 0.166667h;	77%

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: 1422766-81-1
diethyl (1,10-phenanthrolin-5-yl)phosphonate

: CuI(diethyl (1,10-phenanthrolin-5-yl)phosphonate)(triphenylphosphine)bromide

Conditions

Conditions	Yield
In chloroform at 20℃; for 0.166667h;	77%

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: N-[(2-chloro-4-nitrophenyl)carbamothioyl]pentanamide

: {N-[(2-chloro-4-nitrophenyl)carbamothioyl]pentanamide}[bis(triphenylphosphine)]copper(I) bromide

Conditions

Conditions	Yield
In methanol; dichloromethane for 5 - 6h;	77%

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: N-[(2-bromophenyl)carbamothioyl]pentanamide

: {N-[(2-bromophenyl)carbamothioyl]pentanamide}-[bis(triphenylphosphine)]copper(I) bromide

Conditions

Conditions	Yield
In methanol; dichloromethane for 5 - 6h;	75%

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: 591-08-2
acetylthiourea

: bromidoacetylthioureabis(triphenylphosphine)copper(I)

Conditions

Conditions	Yield
In methanol; chloroform at 60℃; for 1h;	74%

: 872-35-5
imidazole-2-thione

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: 242486-22-2
(triphenylphosphine)2(imidazoline-2(1,3H)-thione)(bromo)copper(I)

Conditions

Conditions	Yield
In diethyl ether N2-atmosphere; 2 equivs. of ligand, stirring for 3 h; collection (filtration), washing (Et2O); elem. anal.;	71%

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: 75-09-2
dichloromethane

: (Bu4N)2[Sn3S4(thioglycolate)3]

: 7732-18-5
water

: [(Ph3P)2Cu]2SnS(dithioglycolate)2*2dichloromethane*water

Conditions

Conditions	Yield
In dichloromethane addn. of CH2Cl2 to 1:1 mixt. of copper compd. and tin compd., heating for 5 min; filtration, keeping in air for 3 ds, isolation of crystals, washing withdiethyl ether, drying in air, elem. anal.;	69.4%

...Expand

: 366-18-7
[2,2]bipyridinyl

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: 25753-81-5
(triphenylphosphine)(2,2'-bipyridine)copper(I) bromide

Conditions

Conditions	Yield
In chloroform at 20℃; for 0.5h;	68%
In chloroform at 20℃; for 0.5h;	68%

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: 57774-75-1
ethyl N-(4-bromobenzenecarbothioyl)carbamate

: 505058-73-1
[CuBr(N-carboethoxy-4-bromobenzene thioamide)(PPh3)2]

Conditions

Conditions	Yield
In benzene byproducts: PPh3; soln. N-carboethoxy-4-bromobenzene thioamide (benzene), soln. CuBr(PPh3)3 (benzene); mixed at 25°C; heated under reflux for 0.5 to 1 h; concd. to half volume under reduced pressure; addition of petroleum ether (60-80°C); stand for 2-3 h; filtered;washed several times (petroleum ether); dried in vac.; elem. anal.;	67%

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: 1422766-84-4
diethyl (1,10-phenanthrolin-3-yl)phosphonate

: CuI(diethyl (1,10-phenanthrolin-3-yl)phosphonate)(triphenylphosphine) bromide

Conditions

Conditions	Yield
In chloroform at 20℃; for 0.166667h;	67%

: 15709-74-7
bromotris(triphenylphosphine)copper(I)

: 1422766-85-5
diethyl (1,10-phenanthrolin-4-yl)phosphonate

: C34H32BrCuN2O3P2

Conditions

Conditions	Yield
In chloroform at 20℃; for 0.166667h;	67%

Copper,bromotris(triphenylphosphine)-, (T-4)- Specification

The Copper,bromotris(triphenylphosphine)-, (T-4)- with CAS registry number of 15709-74-7 is also known as Bromotris(triphenylphosphine)copper(I). The systematic name is Bromocopper-triphenylphosphane (1:3). It belongs to product categories of Catalysis and Inorganic Chemistry; Chemical Synthesis; CopperMicro/Nanoelectronics; Electronic Chemicals; Others. In addition, the formula is C₅₄H₄₅BrCuP₃ and the molecular weight is 930.31. During using it, do not breathe dust and avoid contact with skin and eyes. What's more, it should be sealed in cool, dry place away from oxides and air.

Physical properties about Copper,bromotris(triphenylphosphine)-, (T-4)- are: (1)ACD/LogP: 5.69; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.69; (4)ACD/LogD (pH 7.4): 5.69; (5)ACD/BCF (pH 5.5): 12427.96; (6)ACD/BCF (pH 7.4): 12427.96; (7)ACD/KOC (pH 5.5): 29672.91; (8)ACD/KOC (pH 7.4): 29672.91; (9)#Freely Rotating Bonds: 3; (10)Flash Point: 181.7 °C; (11)Enthalpy of Vaporization: 58.18 kJ/mol; (12)Boiling Point: 360 °C at 760 mmHg; (13)Vapour Pressure: 4.74E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. SMILES: Br[Cu].c3c(P(c1ccccc1)c2ccccc2)cccc3.c1ccccc1P(c2ccccc2)c3ccccc3.c1ccccc1P(c2ccccc2)c3ccccc3
2. InChI: InChI=1/3C18H15P.BrH.Cu/c3*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;/h3*1-15H;1H;/q;;;;+1/p-1
3. InChIKey: QXLPGKOIQZWUPL-REWHXWOFAV
4. Std. InChI: InChI=1S/3C18H15P.BrH.Cu/c3*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;/h3*1-15H;1H;/q;;;;+1/p-1
5. Std. InChIKey: QXLPGKOIQZWUPL-UHFFFAOYSA-M

Product Name

BROMOTRIS(TRIPHENYLPHOSPHINE)COPPER(I)&

Synthetic route

Copper,bromotris(triphenylphosphine)-, (T-4)- Specification

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