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Name |
Butyltintrichloride |
EINECS | 214-263-6 |
CAS No. | 1118-46-3 | Density | 1.693 g/mL at 25 °C(lit.) |
PSA | 0.00000 | LogP | 3.44180 |
Solubility | soluble in water | Melting Point |
-63 °C |
Formula | C4H9Cl3Sn | Boiling Point | 226.8 °C at 760 mmHg |
Molecular Weight | 282.184 | Flash Point | 91 °C |
Transport Information | UN 3265 8/PG 2 | Appearance | Clear yellow liquid |
Safety | 26-27-28-36/37/39-45 | Risk Codes | 20/21/22-34-20/21 |
Molecular Structure | Hazard Symbols | C | |
Synonyms |
MBTC;Butyltin trichloride (BuSnCl3);Butyltrichlorostannane;Butyltrichlorotin;Certincoat TC 100;Butyltintrichloride (6CI);NSC 67013;Trichlorobutylstannane;Trichlorobutyltin;n-Butyltin trichloride;Mono-n-butyltin trichloride;Butyltin trichloride; |
Article Data | 32 |
tetra-n-butyltin(IV)
tin(IV) chloride
A
Trichlorbutylstannan
B
dibutyltin chloride
Conditions | Yield |
---|---|
molar ratio of Sn(C4H9)4:SnCl4 = 1:3, 8 h, 203°C; | A 96% B n/a |
molar ratio of Sn(C4H9)4:SnCl4 = 1:3, 8 h, 203°C; | A 96% B n/a |
molar ratio of Sn(C4H9)4:SnCl4 = 1:2, 3 h, 100°C; |
Conditions | Yield |
---|---|
cis-dichlorobis(triphenylphosphine)platinum(II) In toluene stirred for 2 h at 110°C, catalyst added stirred for 12 h at 110°C; cooled to room temp., filtered, ppt. (SnCl2) washed (toluene), dried, filtrate evapd. (vac.), distilled (90°C/11 mm Hg); | A 83% B 3.7% |
cis-dichlorobis(triphenylphosphine)platinum(II) In toluene stirred for 12 h at 110°C; cooled to room temp., filtered, ppt. (SnCl2) washed (toluene), dried, filtrate evapd. (vac.), distilled (90°C/11 mm Hg); elem. anal.; | A 80% B 13% |
cis-dichlorobis(triphenylphosphine)platinum(II) In o-xylene stirred for 12 h at 110°C; cooled to room temp., filtered, ppt. (SnCl2) washed (toluene), dried; NMR; | A n/a B 19% |
Conditions | Yield |
---|---|
In diethyl ether; dichloromethane at -78 - 20℃; for 12.5h; | 80% |
In diethyl ether; dichloromethane at -78 - 20℃; for 12.5h; | 80% |
Conditions | Yield |
---|---|
With stannous chloride; iodine; magnesium In tetrahydrofuran; toluene | 55% |
2-Phenylbutyryl chloride
butyltriphenyltin
A
1,2-diphenyl-butan-1-one
B
Trichlorbutylstannan
Conditions | Yield |
---|---|
With indium In neat (no solvent) at 80℃; for 0.25h; Inert atmosphere; Sonication; regioselective reaction; | A 25% B n/a |
tetra-n-butyltin(IV)
tin(IV) chloride
A
Trichlorbutylstannan
B
dibutyltin chloride
C
tributyltin chloride
Conditions | Yield |
---|---|
With aluminium trichloride 6 h, 100°C; | |
200°C, 10 Torr; | |
molar ratio of educts = 1:1, 0-20°C; | |
With aluminium trichloride 6 h, 100°C; | |
200°C, 10 Torr; |
Conditions | Yield |
---|---|
6 h, 160°C; |
tetra-n-butyltin(IV)
tin(IV) chloride
A
Trichlorbutylstannan
B
tributyltin chloride
Conditions | Yield |
---|---|
molar ratio of educts = 1:1, 0-50°C; |
Trichlorbutylstannan
tetramethylstannane
A
dimethyltin dichloride
B
butyl-methyl-tin dichloride
Conditions | Yield |
---|---|
2-fold excess of C4H9SnCl3, 180°C, 2h; | A n/a B 99.4% |
2-fold excess of C4H9SnCl3, 180°C, 2h; | A n/a B 99.4% |
The Butyl trichloro stannane, with the CAS registry number 1118-46-3 and EINECS registry number 214-263-6, has the systematic name of butyl(trichloro)stannane. It is a kind of clear yellow liquid which is also moisture sensitive. And the molecular formula of the chemical is C4H9Cl3Sn. What's more, it is always used as intensifier of glasses.
The physical properties of Butyl trichloro stannane are as followings: (1)ACD/LogP: 0.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.5; (4)ACD/LogD (pH 7.4): 0.5; (5)ACD/BCF (pH 5.5): 1.42; (6)ACD/BCF (pH 7.4): 1.42; (7)ACD/KOC (pH 5.5): 44.74; (8)ACD/KOC (pH 7.4): 44.74; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 0 Å2; (13)Flash Point: 91 °C; (14)Enthalpy of Vaporization: 44.46 kJ/mol; (15)Boiling Point: 226.8 °C at 760 mmHg; (16)Vapour Pressure: 0.12 mmHg at 25°C.
You should be cautious while dealing with this chemical. It is harmful by inhalation, in contact with skin and if swallowed, and may also cause burns. 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; After contact with skin, take off immediately all contaminated clothing and wash imediately with plenty of.... (to be specified by the manufacturer); In case of accident or if you feel unwell, seek medical advice immediately (show label where possible).
You can still convert the following datas into molecular structure:
(1)SMILES: Cl[Sn](Cl)(Cl)CCCC
(2)InChI: InChI=1/C4H9.3ClH.Sn/c1-3-4-2;;;;/h1,3-4H2,2H3;3*1H;/q;;;;+3/p-3/rC4H9Cl3Sn/c1-2-3-4-8(5,6)7/h2-4H2,1H3
(3)InChIKey: YMLFYGFCXGNERH-YHJCLRPYAB
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
rat | LD50 | oral | 2140mg/kg (2140mg/kg) | "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986Vol. -, Pg. 1245, 1986. |