Conditions | Yield |
---|---|
In water at 20 - 110℃; Temperature; | 98.5% |
In acetic acid byproducts: CO2; neutralizing of BaCO3 with a minimum amt. of glacial acetic acid, boiling; not isolated; |
A
O-ethyl benzoylhydroxamic acid
B
barium(II) acetate
Conditions | Yield |
---|---|
substance of Lossen and Neumann; |
Conditions | Yield |
---|---|
In not given 12 h at 170°C; without or in presence of CO2; |
Conditions | Yield |
---|---|
In water CH3COOH:Ba(OH)2=2.25:0.98 (molar ratio); | |
In water to Ba(OH)2 added excess acetic acid; | |
With diammonium sulfide; oxalic acid; pyrographite In water at 80 - 90℃; for 0.166667h; |
Conditions | Yield |
---|---|
boiling; | |
With water boiling; | |
With water boiling; | |
boiling; |
barium(II) acetate
Conditions | Yield |
---|---|
In neat (no solvent) byproducts: D2O; dehydration at 313-418 K; |
barium acetate monohydrate
barium(II) acetate
Conditions | Yield |
---|---|
In ethanol 42.4°C (or 40.3°C in 96% alc.); detected on the basis of conductivity of soln.; | |
41°C; | |
42.2°C; |
barium(II) acetate
Conditions | Yield |
---|---|
In neat (no solvent) byproducts: D2O; two step dehydration; |
B
barium(II) acetate
Conditions | Yield |
---|---|
In water decompn.;; | |
In water decompn.;; |
barium acetate trihydrate
barium(II) acetate
Conditions | Yield |
---|---|
In neat (no solvent) byproducts: water; dehydration on heating in the temp. range: 323-418 K; |
CH3OC6H3(OH)CHNOCH2(CH2ONCHC6H2(OH)2CHNOCH2)2CH2ONCHC6H3(OH)OCH3
zinc diacetate
barium(II) acetate
Conditions | Yield |
---|---|
In not given ligand reacted with 3 equiv. of Zn acetate and 1 equiv. of Ba acetate; | 99% |
Conditions | Yield |
---|---|
In water for 0.25h; | 95% |
Conditions | Yield |
---|---|
In water; acetonitrile (N2); dissolved at 0°C; filtered through glass microfiber filter into suspension of Ba(CH3COO)2 at 0°C; stirred for 5 min; filtered, dried under vac.; elem. anal.; | 94.4% |
Conditions | Yield |
---|---|
In methanol; chloroform; water soln. of ligand in CHCl3 mixed with soln. of Zn acetate (2 equiv.) and Ba acetate in aq. MeOH; solvent removed; recrystd. from CHCl3-MeOH-ether; elem. anal.; | 86% |
Conditions | Yield |
---|---|
Stage #1: barium(II) acetate; iron(II) acetate With L-Aspartic acid In water at 69.84 - 189.84℃; for 2h; Stage #2: air at 749.84℃; for 5h; Calcination; | 86% |
Conditions | Yield |
---|---|
In isopropyl alcohol byproducts: butanol, acetic acid; addn. of Ti(OBu)4 soln. to oxalic acid soln., addn. of Ba(OAc)2 in waterwith stirring, pptn., filtration, washing (iPrOH), air-drying; TGA, elem. anal.; | 85% |
1H-imidazole
benzene-1,3,5-tricarboxylic acid
water
barium(II) acetate
zinc(II) acetate dihydrate
Conditions | Yield |
---|---|
at 169.84℃; for 48h; Autoclave; High pressure; | 85% |
Conditions | Yield |
---|---|
In methanol; chloroform; water a soln. of Zn salt in MeOH and a soln. of Ba salt in H2O/MeOH added to asoln. of ligand in CHCl3; evapd., crystd. by vapor diffusion of Et2O into a CHCl3/MeOH soln.; elem. anal.; | 84% |
Conditions | Yield |
---|---|
In water molar ratio V2O5:V:H3PO4:Ba(OAc)2:water=1:0.5:23:1:833, Teflon-lined bomb, 200°C, 48 h; collection (filtration), washing (water, Me2CO), drying in air; elem. anal.; | 80% |
In water molar ratio V2O5:V:H3PO4:metal acetate:water=1:0.25:23:2:833, 200°C, 2 d (according to Roca et al, Inorg. Chem. 1997, 36, 3414); elem. anal.; |
Conditions | Yield |
---|---|
With CH3COOLi; N2H4 In water to Pu-compd. in H2O added CH3COOLi, N2H4 and immidiately Ba(CH3COO)2, stirred; coagulated for 20-30 min, filtered, washed with cold H2O, dried in air flow for 3-4 h, elem. anal.; | 80% |
Conditions | Yield |
---|---|
In water addn. of aq. soln. of cobalt chloride and barium acetate to aq. soln. ofpyridine deriv., stirring for 1 h; filtration, evapn. of filtrate for several wks at room temp., isolation of crystals, elem. anal.; | 79% |
Conditions | Yield |
---|---|
In methanol; dichloromethane; water soln. of ligand in CH2Cl2 mixed with soln. of Zn acetate (2 equiv.) and Ca acetate in aq. MeOH; ppt. collected; elem. anal.; | 78% |
1-methyl-pyrrolidin-2-one
1,3,5,-tris(4-carboxyphenyl)benzene
water
barium(II) acetate
Conditions | Yield |
---|---|
at 105℃; for 72h; Sealed tube; | 75% |
Conditions | Yield |
---|---|
In water molar ratio V2O5:V:H3AsO4:metal acetate:water=1:0.5:6.25:2:1250, Teflon-lined bomb, 170°C, 2 d; collection (filtration), washing (water, Me2CO); | 70% |
Conditions | Yield |
---|---|
With potassium nitrate; zinc(II) chloride In water at 210℃; for 96h; High pressure; Autoclave; | 67% |
barium(II) acetate
Conditions | Yield |
---|---|
In methanol; water at 20℃; for 0.166667h; | 65.7% |
Conditions | Yield |
---|---|
In ethanol; chloroform | 65.3% |
Conditions | Yield |
---|---|
at 210℃; for 96h; | 60% |
Conditions | Yield |
---|---|
With lithium chloride In water at 120 - 220℃; Autoclave; | 55% |
Conditions | Yield |
---|---|
In methanol; chloroform; water | 51% |
Conditions | Yield |
---|---|
In methanol; chloroform; water soln. of ligand in CHCl3 mixed with soln. of Zn acetate (2 equiv.) and Ca acetate in aq. MeOH; ppt. collected; elem. anal.; | 48% |
barium(II) acetate
4-hydroxybutyl phosphate
4-hydroxybutyl phosphate barium salt
Conditions | Yield |
---|---|
at 20℃; pH=9; | 41% |
ethanol
water
barium(II) acetate
cobalt(II) diacetate tetrahydrate
Conditions | Yield |
---|---|
at 20℃; | 39.65% |
methanol
water
barium(II) acetate
nickel(II) acetate tetrahydrate
Conditions | Yield |
---|---|
In dichloromethane | 38.69% |
Conditions | Yield |
---|---|
In water at 140℃; | 34% |
barium(II) acetate
5-bromo-2-phenyl-4,5,6,7-tetrahydro-benzo[b]furan-4-one
5-acetoxy-2-phenyl-4,5,6,7-tetrahydro-benzo[b]furan-4-one
Conditions | Yield |
---|---|
In acetic anhydride; acetic acid for 25h; Acetoxylation; Heating; | 30% |
methanol
chloroform
barium(II) acetate
zinc(II) acetate dihydrate
Conditions | Yield |
---|---|
In water | 25.1% |
Conditions | Yield |
---|---|
In methanol; chloroform; water soln. of ligand in CHCl3 mixed with soln. of Zn acetate (2 equiv.) and Ca acetate in aq. MeOH; ppt. collected; elem. anal.; | 9% |
Conditions | Yield |
---|---|
at 160℃; for 24h; Autoclave; | 0.3% |
Reported in EPA TSCA Inventory. Barium and its compounds are on the Community Right-To-Know List.
OSHA PEL: TWA 0.5 mg(Ba)/m3
ACGIH TLV: TWA 0.5 mg(Ba)/m3; Not Classifiable as a Human Carcinogen
DFG MAK: 0.5 mg(Ba)/m3
The Barium acetate, with the CAS registry number 543-80-6 and EINECS registry number 208-849-0, has the systematic name of barium diacetate. It is a kind of whitepowder, and belongs to the following product categories: Industrial/Fine Chemicals; Inorganic Chemicals; Organic-metal salt; A-B, Puriss p.a. ACSSynthetic Reagents; Analytical Reagents for General Use; Puriss p.a. ACS; BariumMicro/Nanoelectronics; Barium; Inorganic Salts; Solution Deposition Precursors; Synthetic Reagents; ACS GradeSynthetic Reagents; Essential Chemicals; Routine Reagents. And the molecular formula of this chemical is C4H8BaO4.
The Barium acetate is the salt of barium(II) and acetic acid, and it is highly soluble: 55.8 g of barium acetate can be dissolved in 100g of water at 0 °C. Barium acetate decomposes upon heating into barium carbonate. And when reacts with acids, such as sulfuric acid, hydrochloric acid and nitric acid, the reaction give the sulfate, chloride and nitrate respectively.
The physical properties of Barium acetate are as followings: (1)ACD/LogP: -0.29; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.07; (4)ACD/LogD (pH 7.4): -2.86; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 2.73; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 37.3 Å2; (13)Flash Point: 40 °C; (14)Enthalpy of Vaporization: 23.7 kJ/mol; (15)Boiling Point: 117.1 °C at 760 mmHg; (16)Vapour Pressure: 13.9 mmHg at 25°C.
Preparation: It is generally produced by the reaction of acetic acid with barium carbonate. And the reaction is performed in solution and the barium acetate crystallizes out.
BaCO3 + 2CH3COOH → (CH3COO)2Ba + CO2 + H2O
Uses of Barium acetate: It is usually used as a mordant for printing textile fabrics, for drying paints and varnishes and in lubricating oil. What's more, it is also used in the preparation of other acetates, and as a catalyst in organic synthesis in chemistry.
You should be cautious while dealing with this chemical. It is harmful by inhalation and if swallowed. Therefore, you had better take the instruction: After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer).
You can still convert the following datas into molecular structure:
(1)SMILES: [Ba+2].[O-]C(=O)C.[O-]C(=O)C
(2)InChI: InChI=1/2C2H4O2.Ba/c2*1-2(3)4;/h2*1H3,(H,3,4);/q;;+2/p-2
(3)InChIKey: ITHZDDVSAWDQPZ-NUQVWONBAA
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intravenous | 21mg/kg (21mg/kg) | Toxicology and Applied Pharmacology. Vol. 22, Pg. 150, 1972. | |
rabbit | LDLo | intravenous | 12mg/kg (12mg/kg) | Environmental Quality and Safety, Supplement. Vol. 1, Pg. 1, 1975. | |
rabbit | LDLo | oral | 236mg/kg (236mg/kg) | Environmental Quality and Safety, Supplement. Vol. 1, Pg. 1, 1975. | |
rabbit | LDLo | subcutaneous | 96mg/kg (96mg/kg) | Environmental Quality and Safety, Supplement. Vol. 1, Pg. 1, 1975. | |
rat | LD50 | oral | 921mg/kg (921mg/kg) | Personal Communication from J.V. Marhold, VUOS, 539-18, Pardubice, Czechoslavakia, Mar. 29, 1977Vol. 29MAR1977, |
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