Chemical Properties of ozone (CAS 10028-15-6)

ozone

InChI
InChI=1S/O3/c1-3-2
InChI Key
CBENFWSGALASAD-UHFFFAOYSA-N
Formula
O3
SMILES
O=[O+][O-]
Molecular Weight1
48.00
CAS
10028-15-6
Other Names
  • TRIATOMIC OXYGEN
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Physical Properties

Property Value Unit Source
ω [0.1947; 0.2240]   Show Hide
ω 0.2240 ChemSep v8.3 pure component data
ω 0.1947 KDB
PAff 625.50 kJ/mol NIST
BasG 595.90 kJ/mol NIST
μ [0.54; 0.60] debye Show Hide
μ 0.54 debye ChemSep v8.3 pure component data
μ 0.60 debye KDB
EA [1.82; 2.14] eV Show Hide
EA 2.10 ± 0.00 eV NIST
EA 2.10 ± 0.00 eV NIST
EA 2.14 ± 0.15 eV NIST
EA 1.91 ± 0.14 eV NIST
EA 1.82 eV NIST
EA 1.96 eV NIST
ΔfG° [162.90; 163.16] kJ/mol Show Hide
ΔfG° 163.16 kJ/mol ChemSep v8.3 pure component data
ΔfG° 162.90 kJ/mol KDB
ΔfH°gas [142.80; 143.10] kJ/mol Show Hide
ΔfH°gas 143.10 kJ/mol ChemSep v8.3 pure component data
ΔfH°gas 142.80 kJ/mol KDB
IE [12.30; 12.89] eV Show Hide
IE 12.53 ± 0.08 eV NIST
IE 12.43 eV NIST
IE 12.52 ± 0.00 eV NIST
IE 12.50 ± 0.10 eV NIST
IE 12.44 ± 0.01 eV NIST
IE 12.56 eV NIST
IE 12.67 eV NIST
IE 12.30 ± 0.10 eV NIST
IE 12.89 ± 0.10 eV NIST
IE 12.80 ± 0.05 eV NIST
IE 12.73 eV NIST
logPoct/wat -1.122 Crippen Calculated Property
McVol 24.170 ml/mol McGowan Calculated Property
Pc [5570.00; 5570.00] kPa Show Hide
Pc 5570.00 kPa ChemSep v8.3 pure component data
Pc 5570.00 kPa Air Liquide Gas Encyclopedia
Pc 5570.00 kPa KDB
Ptriple [7.35e-04; 7.35e-04] kPa Show Hide
Ptriple 7.35e-04 kPa ChemSep v8.3 pure component data
Ptriple 7.35e-04 kPa Air Liquide Gas Encyclopedia
ρc 539.31 kg/m3 Air Liquide Gas Encyclopedia
Tboil [161.30; 161.85] K Show Hide
Tboil 161.80 K ChemSep v8.3 pure component data
Tboil 161.85 K Air Liquide Gas Encyclopedia
Tboil 161.80 K KDB
Tboil 161.30 ± 0.50 K NIST
Tc [261.00; 261.15] K Show Hide
Tc 261.05 K ChemSep v8.3 pure component data
Tc 261.00 K Air Liquide Gas Encyclopedia
Tc 261.10 K KDB
Tc 261.15 ± 1.50 K NIST
Tc 261.05 ± 1.00 K NIST
Tfus [22.15; 80.70] K Show Hide
Tfus 22.15 K ChemSep v8.3 pure component data
Tfus 80.15 K Air Liquide Gas Encyclopedia
Tfus 80.00 K KDB
Tfus 80.70 ± 0.50 K NIST
Ttriple [80.15; 80.15] K Show Hide
Ttriple 80.15 K ChemSep v8.3 pure component data
Ttriple 80.15 K Air Liquide Gas Encyclopedia
UQi 1.27 ChemSep v8.3 pure component data
URi 1.10 ChemSep v8.3 pure component data
Vc [0.089; 0.089] m3/kmol Show Hide
Vc 0.089 m3/kmol ChemSep v8.3 pure component data
Vc 0.089 m3/kmol KDB
Zc [0.2283500; 0.2290000]   Show Hide
Zc 0.2290000 ChemSep v8.3 pure component data
Zc 0.2283500 KDB
Zra 0.25 ChemSep v8.3 pure component data

Cheméo can also estimate Enthalpy of vaporization at standard conditions, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
ΔfusH 2.00 kJ/mol 80.15 Air Liquide Gas Encyclopedia
ΔvapH 13.85 kJ/mol 161.85 Air Liquide Gas Encyclopedia
ρl [1349.08; 1356.00] kg/m3 [161.00; 161.85] Show Hide
ρl 1356.00 kg/m3 161.00 KDB
ρl 1349.08 kg/m3 161.85 Air Liquide Gas Encyclopedia

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [32.86; 58.10] J/mol×K [50.00; 1500.00] ChemSep v8.3 pure component data Show Hide
EquationY = A + exp(B/T + C + D·T + E·T²)
Y is Cp,gas in J/mol×K, T in K
Coefficient A3.28596e+01
Coefficient B-6.04741e+02
Coefficient C4.00431e+00
Coefficient D-2.87995e-04
Coefficient E2.63241e-08
CommentChemSep eq 16, IdealGasHeatCapacityCp
Temperature range, min.50.00
Temperature range, max.1500.00
Cp,gas 32.86 J/mol×K 50.00 Calculated Property
Cp,gas 35.80 J/mol×K 211.11 Calculated Property
Cp,gas 42.60 J/mol×K 372.22 Calculated Property
Cp,gas 48.11 J/mol×K 533.33 Calculated Property
Cp,gas 51.89 J/mol×K 694.44 Calculated Property
Cp,gas 54.41 J/mol×K 855.56 Calculated Property
Cp,gas 56.05 J/mol×K 1016.67 Calculated Property
Cp,gas 57.10 J/mol×K 1177.78 Calculated Property
Cp,gas 57.74 J/mol×K 1338.89 Calculated Property
Cp,gas 58.10 J/mol×K 1500.00 Calculated Property
Cp,gas [39.22; 56.20] J/mol×K [298.00; 1200.00] NIST Show Hide
EquationY = A + B·t + C·t² + D·t³ + E/t², t = T/1000
Y is Cp,gas in J/mol×K, T in K
Coefficient A2.16616e+01
Coefficient B7.98600e+01
Coefficient C-6.60260e+01
Coefficient D1.95836e+01
Coefficient E-7.92510e-02
ReferenceChase, 1998
CommentF=132.9407, G=243.6406, H=142.6740; Data last reviewed in June, 1961
Temperature range, min.298.00
Temperature range, max.1200.00
Cp,gas 39.22 J/mol×K 298.00 Calculated Property
Cp,gas 43.73 J/mol×K 398.22 Calculated Property
Cp,gas 47.17 J/mol×K 498.44 Calculated Property
Cp,gas 49.79 J/mol×K 598.67 Calculated Property
Cp,gas 51.75 J/mol×K 698.89 Calculated Property
Cp,gas 53.19 J/mol×K 799.11 Calculated Property
Cp,gas 54.23 J/mol×K 899.33 Calculated Property
Cp,gas 55.00 J/mol×K 999.56 Calculated Property
Cp,gas 55.62 J/mol×K 1099.78 Calculated Property
Cp,gas 56.20 J/mol×K 1200.00 Calculated Property
Cp,gas [56.17; 61.25] J/mol×K [1200.00; 6000.00] NIST Show Hide
EquationY = A + B·t + C·t² + D·t³ + E/t², t = T/1000
Y is Cp,gas in J/mol×K, T in K
Coefficient A5.78141e+01
Coefficient B7.30941e-01
Coefficient C-3.92530e-02
Coefficient D2.61000e-03
Coefficient E-3.56037e+00
ReferenceChase, 1998
CommentF=115.7717, G=294.5607, H=142.6740; Data last reviewed in June, 1961
Temperature range, min.1200.00
Temperature range, max.6000.00
Cp,gas 56.17 J/mol×K 1200.00 Calculated Property
Cp,gas 57.79 J/mol×K 1733.33 Calculated Property
Cp,gas 58.61 J/mol×K 2266.67 Calculated Property
Cp,gas 59.16 J/mol×K 2800.00 Calculated Property
Cp,gas 59.59 J/mol×K 3333.33 Calculated Property
Cp,gas 59.97 J/mol×K 3866.67 Calculated Property
Cp,gas 60.31 J/mol×K 4400.00 Calculated Property
Cp,gas 60.63 J/mol×K 4933.33 Calculated Property
Cp,gas 60.94 J/mol×K 5466.67 Calculated Property
Cp,gas 61.25 J/mol×K 6000.00 Calculated Property
Property Value Unit Temperature (K) Source
Cp,liquid [85.35; 102.22] J/mol×K [90.00; 150.00] ChemSep v8.3 pure component data Show Hide
EquationY = A + exp(B/T + C + D·T + E·T²)
Y is Cp,liquid in J/mol×K, T in K
Coefficient A6.45000e+01
Coefficient B-6.02050e+01
Coefficient C3.07094e+00
Coefficient D8.04340e-03
Coefficient E-1.09290e-05
CommentChemSep eq 16, LiquidHeatCapacityCp
Temperature range, min.90.00
Temperature range, max.150.00
Cp,liquid 85.35 J/mol×K 90.00 Calculated Property
Cp,liquid 87.23 J/mol×K 96.67 Calculated Property
Cp,liquid 89.10 J/mol×K 103.33 Calculated Property
Cp,liquid 90.97 J/mol×K 110.00 Calculated Property
Cp,liquid 92.85 J/mol×K 116.67 Calculated Property
Cp,liquid 94.72 J/mol×K 123.33 Calculated Property
Cp,liquid 96.60 J/mol×K 130.00 Calculated Property
Cp,liquid 98.47 J/mol×K 136.67 Calculated Property
Cp,liquid 100.35 J/mol×K 143.33 Calculated Property
Cp,liquid 102.22 J/mol×K 150.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0041022; 0.0001175] Pa×s [77.55; 208.80] ChemSep v8.3 pure component data Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-3.70360e+01
Coefficient B8.15780e+02
Coefficient C4.89710e+00
Coefficient D-4.76460e-05
Coefficient E2.00000e+00
CommentChemSep eq 101, LiquidViscosity
Temperature range, min.77.55
Temperature range, max.208.80
η 0.0041022 Pa×s 77.55 Calculated Property
η 0.0016038 Pa×s 92.13 Calculated Property
η 0.0008554 Pa×s 106.72 Calculated Property
η 0.0005453 Pa×s 121.30 Calculated Property
η 0.0003864 Pa×s 135.88 Calculated Property
η 0.0002916 Pa×s 150.47 Calculated Property
η 0.0002281 Pa×s 165.05 Calculated Property
η 0.0001820 Pa×s 179.63 Calculated Property
η 0.0001463 Pa×s 194.22 Calculated Property
η 0.0001175 Pa×s 208.80 Calculated Property
Property Value Unit Temperature (K) Source
ΔvapH [16.15; 1.69] kJ/mol [80.15; 261.00] ChemSep v8.3 pure component data Show Hide
EquationY = A·(1 − Tr)^(B + C·Tr + D·Tr² + E·Tr³), Tr = T/Tc
Y is ΔvapH in kJ/mol, T in K
Coefficient A1.62540e+01
Coefficient B-7.34470e-02
Coefficient C1.48230e-01
Coefficient D6.22250e-01
Coefficient E-4.32770e-01
Critical temperature, Tc (K)2.61050e+02
CommentChemSep eq 106, HeatOfVaporization
Temperature range, min.80.15
Temperature range, max.261.00
ΔvapH 16.15 kJ/mol 80.15 Calculated Property
ΔvapH 15.86 kJ/mol 100.24 Calculated Property
ΔvapH 15.42 kJ/mol 120.34 Calculated Property
ΔvapH 14.83 kJ/mol 140.43 Calculated Property
ΔvapH 14.05 kJ/mol 160.53 Calculated Property
ΔvapH 13.09 kJ/mol 180.62 Calculated Property
ΔvapH 11.92 kJ/mol 200.72 Calculated Property
ΔvapH 10.47 kJ/mol 220.81 Calculated Property
ΔvapH 8.50 kJ/mol 240.91 Calculated Property
ΔvapH 1.69 kJ/mol 261.00 Calculated Property
Property Value Unit Temperature (K) Source
Pvap [2.79e-04; 5578.47] kPa [80.15; 261.00] The Yaws Handbook of Vapor Pressure Show Hide
Equationln(Y) = A + B/(T + C)
Y is Pvap in kPa, T in K
Coefficient A1.44711e+01
Coefficient B-1.42440e+03
Coefficient C-1.72800e+01
Temperature range, min.80.15
Temperature range, max.261.00
Pvap 2.79e-04 kPa 80.15 Calculated Property
Pvap 0.07 kPa 100.24 Calculated Property
Pvap 1.92 kPa 120.34 Calculated Property
Pvap 18.27 kPa 140.43 Calculated Property
Pvap 92.53 kPa 160.53 Calculated Property
Pvap 314.43 kPa 180.62 Calculated Property
Pvap 817.30 kPa 200.72 Calculated Property
Pvap 1759.25 kPa 220.81 Calculated Property
Pvap 3299.43 kPa 240.91 Calculated Property
Pvap 5578.47 kPa 261.00 Calculated Property
Pvap [8.55e-04; 5429.09] kPa [80.15; 261.00] ChemSep v8.3 pure component data Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is Pvap in kPa, T in K
Coefficient A2.68924e+01
Coefficient B-2.06626e+03
Coefficient C-1.86514e+00
Coefficient D3.69700e-08
Coefficient E2.00000e+00
CommentChemSep eq 101, VaporPressure
Temperature range, min.80.15
Temperature range, max.261.00
Pvap 8.55e-04 kPa 80.15 Calculated Property
Pvap 0.10 kPa 100.24 Calculated Property
Pvap 2.20 kPa 120.34 Calculated Property
Pvap 19.24 kPa 140.43 Calculated Property
Pvap 94.59 kPa 160.53 Calculated Property
Pvap 317.93 kPa 180.62 Calculated Property
Pvap 821.08 kPa 200.72 Calculated Property
Pvap 1754.25 kPa 220.81 Calculated Property
Pvap 3255.92 kPa 240.91 Calculated Property
Pvap 5429.09 kPa 261.00 Calculated Property
Pvap [0.12; 104.72] kPa [92.80; 162.00] NIST Show Hide
Equationln(Y) = A + B/(T + C)
Y is Pvap in kPa, T in K
Coefficient A1.43598e+01
Coefficient B-1.64056e+03
Coefficient C6.98200e+00
ReferenceStull, 1947
CommentCoefficents calculated by NIST from author's data.
Temperature range, min.92.80
Temperature range, max.162.00
Pvap 0.12 kPa 92.80 Calculated Property
Pvap 0.40 kPa 100.49 Calculated Property
Pvap 1.12 kPa 108.18 Calculated Property
Pvap 2.73 kPa 115.87 Calculated Property
Pvap 6.00 kPa 123.56 Calculated Property
Pvap 12.07 kPa 131.24 Calculated Property
Pvap 22.57 kPa 138.93 Calculated Property
Pvap 39.62 kPa 146.62 Calculated Property
Pvap 65.92 kPa 154.31 Calculated Property
Pvap 104.72 kPa 162.00 Calculated Property
Property Value Unit Temperature (K) Source
ρl [1608.38; 556.91] kg/m3 [77.55; 261.00] ChemSep v8.3 pure component data Show Hide
EquationY = A / B^(1 + (1 − T/C)^D)
Y is ρl in kg/m3, T in K
Coefficient A1.26869e+02
Coefficient B2.65440e-01
Coefficient C2.61050e+02
Coefficient D2.52390e-01
CommentChemSep eq 105, LiquidDensity
Temperature range, min.77.55
Temperature range, max.261.00
ρl 1608.38 kg/m3 77.55 Calculated Property
ρl 1552.23 kg/m3 97.93 Calculated Property
ρl 1492.82 kg/m3 118.32 Calculated Property
ρl 1429.36 kg/m3 138.70 Calculated Property
ρl 1360.68 kg/m3 159.08 Calculated Property
ρl 1284.95 kg/m3 179.47 Calculated Property
ρl 1199.02 kg/m3 199.85 Calculated Property
ρl 1096.50 kg/m3 220.23 Calculated Property
ρl 959.90 kg/m3 240.62 Calculated Property
ρl 556.91 kg/m3 261.00 Calculated Property
Property Value Unit Temperature (K) Source
γ [0.04; 2.67e-05] N/m [77.20; 261.00] ChemSep v8.3 pure component data Show Hide
EquationY = A + exp(B/T + C + D·T + E·T²)
Y is γ in N/m, T in K
Coefficient A-8.38750e-03
Coefficient B7.04170e+01
Coefficient C-4.45110e+00
Coefficient D1.15550e-02
Coefficient E-5.30290e-05
CommentChemSep eq 16, SurfaceTension
Temperature range, min.77.20
Temperature range, max.261.00
γ 0.04 N/m 77.20 Calculated Property
γ 0.04 N/m 97.62 Calculated Property
γ 0.03 N/m 118.04 Calculated Property
γ 0.03 N/m 138.47 Calculated Property
γ 0.02 N/m 158.89 Calculated Property
γ 0.02 N/m 179.31 Calculated Property
γ 0.01 N/m 199.73 Calculated Property
γ 0.01 N/m 220.16 Calculated Property
γ 0.00 N/m 240.58 Calculated Property
γ 2.67e-05 N/m 261.00 Calculated Property
Property Value Unit Temperature (K) Source
λ [0.01; 0.07] W/m×K [161.85; 1000.00] ChemSep v8.3 pure component data Show Hide
EquationY = A·T^B / (1 + C/T + D/T²)
Y is λ in W/m×K, T in K
Coefficient A4.39070e-03
Coefficient B4.78320e-01
Coefficient C7.09480e+02
Coefficient D2.33720e+02
CommentChemSep eq 102, VaporThermalConductivity
Temperature range, min.161.85
Temperature range, max.1000.00
λ 0.01 W/m×K 161.85 Calculated Property
λ 0.02 W/m×K 254.98 Calculated Property
λ 0.02 W/m×K 348.11 Calculated Property
λ 0.03 W/m×K 441.23 Calculated Property
λ 0.04 W/m×K 534.36 Calculated Property
λ 0.04 W/m×K 627.49 Calculated Property
λ 0.05 W/m×K 720.62 Calculated Property
λ 0.06 W/m×K 813.74 Calculated Property
λ 0.06 W/m×K 906.87 Calculated Property
λ 0.07 W/m×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
λ [0.23; 0.23] W/m×K [77.35; 161.85] ChemSep v8.3 pure component data Show Hide
EquationY = A + exp(B/T + C + D·T + E·T²)
Y is λ in W/m×K, T in K
Coefficient A2.32550e-01
Coefficient B-6.78090e+02
Coefficient C-6.57050e+00
Coefficient D-7.49770e-02
Coefficient E2.53910e-04
CommentChemSep eq 16, LiquidThermalConductivity
Temperature range, min.77.35
Temperature range, max.161.85
λ 0.23 W/m×K 77.35 Calculated Property
λ 0.23 W/m×K 86.74 Calculated Property
λ 0.23 W/m×K 96.13 Calculated Property
λ 0.23 W/m×K 105.52 Calculated Property
λ 0.23 W/m×K 114.91 Calculated Property
λ 0.23 W/m×K 124.29 Calculated Property
λ 0.23 W/m×K 133.68 Calculated Property
λ 0.23 W/m×K 143.07 Calculated Property
λ 0.23 W/m×K 152.46 Calculated Property
λ 0.23 W/m×K 161.85 Calculated Property

Similar Compounds

Oxygen cation. Oxygen anion. Oxygen. Hydroperoxy radical. ClOO. disodium peroxide. hydrogen peroxide. copper sulphide. barium peroxide. Strontium monofluoride. Phosphorus monoxide. fluorine. calcium peroxide. Carbon trimer. Nitrogen oxide cation.

Find more compounds similar to ozone.

Sources

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