Stoichiometry Dr. Ron Rusay Chemical Stoichiometry Stoichiometry is the study of mass in chemical reactions. It deals with both reactants and products. It quantitatively and empirically relates the behavior of atoms and molecules in a balanced chemical equation to observable chemical change and measurable mass effects. It accounts for mass and the conservation of mass, just as the conservation of atoms in a balanced chemical equation. Chemical Reactions Atoms, Mass & Balance: eg. Zn(s) + S(s) Chemical Equation Representation of a chemical reaction: _ C2H5OH + _ O2 _ CO2 + _ H2O Reactants Products • C=2; H =5+1=6; O=2+1 • C=1; H=2; O=2+1 1 C2H5OH + 3 O2 2 CO2 + 3 H2O Chemical Equation C2H5OH + 3 O2 2 CO2 + 3 H2O The balanced equation can be completely stated as: 1 mole of ethanol reacts with 3 moles of oxygen to produce 2 moles of carbon dioxide and 3 moles of water. Chemical Equation 1 All Balanced Equations relate on a molar mass basis. For the combustion of octane: 2 C8H18(l)+ 25 O2(g) 16 CO2(g) +18 H2O(l) 2 moles of octane react with 25 moles of oxygen to produce 16 moles of carbon dioxide and 18 moles of water. QUESTION The fuel in small portable lighters is butane (C4H10). After using a lighter for a few minutes, 1.0 gram of fuel was used. How many moles of carbon dioxide would it produce? A. B. C. D. 58 moles 0.017 moles 1.7 10–24 moles 0.068 moles ANSWER The fuel in small portable lighters is butane (C4H10). After using a lighter for a few minutes, 1.0 gram of fuel was used. How many moles of carbon dioxide would it produce? A. B. C. D. 58 moles 0.017 moles 1.7 10–24 moles 0.068 moles 2 C4H10(g) + 13 O2(g) 8 CO2(g) + 10 H2O(g) The molar mass of butane: 4 12g/mol = 48 for carbon + 10 1g/mol = 10.0 for hydrogen. Total = 48.0 + 10.0 = 58.0 g/mol. Next; 1.0 gram of butane 1 mol/58.0 g = 0.017 mol The Chemical Equation: Mole & Masses C2H5OH + 3 O2 2 CO2 + 3 H2O 46g (1 mole) of ethanol reacts with 3 moles of oxygen (96g) to produce 2 moles of carbon dioxide and 3 moles of water. How many grams of carbon dioxide and water are respectively produced from 46g (1 mole) of ethanol ? 2 mol x 44 g/mol = 88g 3 mol x 18 g/mol = 54 g The Chemical Equation: Moles & Masses • C2H5OH + 3 O2 2 CO2 + 3 H2O How many grams of oxygen are needed to react with 15.3g of ethanol in a 12oz. beer ? 15.3gethanol x molethanol /46.0gethanol = 0.333molethanol 0.333molethanol x 3moloxygen / 1molethanol = 0.999moloxygen 32.0goxygen /moloxygen x 0.999moloxygen = 32.0goxygen NOTE: It takes approximately 1 hour for the biologically equivalent amount of oxygen available from cytochrome p450 to consume the alcohol in a human in 1 beer to a level below the legal limit of 0.08%. Chemical Stoichiometry Epsom salt (magnesium sulfate heptahydrate) is one of five possible hydrates: mono-, di-, tri-, hexa-, or hepta- hydrate. How can stoichiometry be used to determine, which hydrate is present in a pure unknown sample, by heating the sample in a kitchen oven at 400 o C for 45 minutes? MgSO4 . x H2O(s) MgSO4 (s) + x H2O (g) Mass Calculations 1 All Balanced Equations relate on a molar and mass basis. For the combustion of octane: 2 C8H18(l)+ 25 O2(g) 16 CO2(g) +18 H2O(l) 228 g of octane (2 moles)* will react with 800 g of oxygen (25 moles) to produce (16 moles) 704 g of carbon dioxide and (18 moles) 324 g of water. *(2 moles octane x 114 g/mol = 228 g ) Mass Calculations: Reactants Products Chemically Relate: Something (S) Another Thing (AT) Mass (S) Mass (AT) grams (S) grams (AT) Mass Calculations: Reactants Products 1. 2. 3. 4. 5. Balance the chemical equation. Convert mass of reactant or product to moles. Identify mole ratios in balanced equation: They serve as the “Gatekeeper”. Calculate moles of desired product or reactant. Convert moles to grams. Mass Calculations: Reactants Products grams (S) grams (S) 1 mol (S) grams (AT) Avogadro's Number Atoms Molecules Stoichiometry grams (AT) (Molecular Weight) ? grams (AT) grams (S) (Molecular Weight) ? "Gatekeeper" 1 mol (AT) Mass Calculations: Reactants Products • How many grams of salicylic acid are needed to produce 1.80 kg of aspirin? • Balanced Equation: Salicylic Acid Aspirin COOH H COOH OH H + H OCCH3 + CH3COCl H H H C7H6O3 MW = 138.12 O HCl H H C2H3OCl MW = 78.49 C9H8O4 MW = 180.15 HCl MW= 36.45 Mass Calculations: Reactants Products grams (Aspirin) grams (Salicylic Acid) Avogadro's Number Atoms Molecules Stoichiometry grams (SA) 1800 grams (A) 1 mol (A) 1 mol SA (Molecular Weight SA) ? (SA) grams (A) 1 mol A (Molecular Weight A) "Gatekeeper" 1 mol (SA) Mass Calculations: How many grams of salicylic acid are needed to produce 1.80 kg of aspirin? • Balanced Equation: Salicylic Acid Aspirin COOH H COOH OH H + H H C7H6O3 MW = 138.12 OCCH3 + CH3COCl H H 1 O HCl H H C2H3OCl MW = 78.49 1 C9H8O4 MW = 180.15 HCl MW= 36.45 ?g C7 = 1.80 x 103 gC9 x [molC9 /180.15gC9 ] x [1 molC7/ 1 molC9] x 138.12 gC7/molC7 ?g C7 = 1380 grams Mass Calculations: Reactants Products QUESTION The fuel in small portable lighters is butane (C4H10). After using a lighter for a few minutes, 1.0 gram (0.017 moles) of fuel was used. How many grams of carbon dioxide would it produce? 2 C4H10(g) + 13 O2(g) 8 CO2(g) + 10 H2O(g) How many grams of carbon dioxide would this produce? A.) 750 mg B.) 6.0 g C) 1.5 g D.) 3.0 g ANSWER D.) 3.0 g 2 C4H10(g) + 13 O2(g) 8 CO2(g) + 10 H2O(g) C4H10 1.0 g grams (S) 1.0 g C4H10 ?g CO2 grams (S) grams (AT) mol C4H10 1 mol (S) Avogadro's Number Atoms Molecules 44 g CO2 8Stoichiometry mol grams (AT) CO2 (Molecular Weight) ? 3.0 g CO2 ?g CO2 grams (AT) grams (S) (Molecular Weight) 58 g C4H10 2 mol ? C4H10 "Gatekeeper" 1 mol (AT) mol CO2 Combustion Analysis • CxHy + (x + y/4) O2 x CO2 + y/2 H2O Molecules with oxygen in their formula are more difficult to solve for Oz knowing only the respective masses of CxHyOz sample, CO2 and H2O. • CxHyOz + (x + y/4 - z) O2 x CO2 + y/2 H2O SEE: COMPARISON to wt % CALCULATIONS Combustion Analysis Calculation Ascorbic Acid ( Vitamin C ) • Combustion of a 6.49 mg sample in excess oxygen, yielded 9.74 mg CO2 and 2.64 mg H2O • Calculate it’s Empirical formula! • C: 9.74 x10-3g CO2 x(12.01 g C/44.01 g CO2) = 2.65 x 10-3 g C • H: 2.64 x10-3g H2O x (2.016 g H2/18.02 gH2O) = 2.92 x 10-4 g H • Mass Oxygen = 6.49 mg - 2.65 mg - 0.30 mg = 3.54 mg O Vitamin C: Calculation (continued) • C = 2.65 x 10-3 g C / ( 12.01 g C / mol C ) = = 2.21 x 10-4 mol C • H = 0.295 x 10-3 g H / ( 1.008 g H / mol H ) = = 2.92 x 10-4 mol H • O = 3.54 x 10-3 g O / ( 16.00 g O / mol O ) = = 2.21 x 10-4 mol O • Divide each by 2.21 x 10-4 • C = 1.00 Multiply each by 3 = 3.00 = 3.0 • H = 1.32 = 3.96 = 4.0 • O = 1.00 = 3.00 = 3.0 C3H4O3 QUESTION Erythrose contains carbon, hydrogen and oxygen (MM = 120.0 g/mol). It is an important sugar that is used in many chemical syntheses. Combustion analysis of a 700.0 mg sample yielded 1.027 g CO2 and 0.4194 g H2O. Mass Spectrometry produced a molecular ion @ 120 mass units (m/z). What is the molecular formula of erythrose? A) B) C) D) CH2O C6H12O6 C3H6O3 C4H8O4 ANSWER D) C4H8O4 Alternative Solution Method Mass ratio of C in CO2 = mol C x M of C = mass of 1 mol CO2 = 1 mol C x 12.01 g C/ 1 mol C = 0.2729 g C / 1 g CO2 44.01 g CO2 mol H x M of H = mass of 1 mol H2O 2 mol H x 1.008 g H / 1 mol H = = 0.1119 g H / 1 g H2O 18.02 g H2O Mass ratio of H in H2O = Calculating masses of C and H: Mass of Element = mass of compound x mass ratio of element Alternative Method Mass (g) of C = 1.027 g CO2 x 0.2729 g C 1 g CO2 = 0.2803 g C 0.1119 g H Mass (g) of H = 0.4194 g H2O x = 0.04693 g H 1 g H2O Calculating the mass of O: Mass (g) of O = Sample mass -( mass of C + mass of H ) = 0.700 g - 0.2803 g C - 0.04693 g H = 0.37277 g O Calculating moles of each element: C = 0.2803 g C / 12.01 g C/ mol C = 0.02334 mol C H = 0.04693 g H / 1.008 g H / mol H = 0.04656 mol H O = 0.37277 g O / 16.00 g O / mol O = 0.02330 mol O C0.02334H0.04656O0.02330 = CH2O formula weight = 30 g / formula 120 g /mol / 30 g / formula = 4 formula units / cmpd = C4H8O4