Property | Value | Unit | Source |
---|---|---|---|
ΔcH°solid | -2923.30 ± 2.50 | kJ/mol | NIST |
EA | [1.11; 1.34] | eV | |
EA | 1.16 ± 0.10 | eV | NIST |
EA | 1.11 ± 0.05 | eV | NIST |
EA | 1.34 ± 0.05 | eV | NIST |
ΔfG° | 126.04 | kJ/mol | Joback Calculated Property |
ΔfH°gas | 31.39 | kJ/mol | Joback Calculated Property |
ΔfH°solid | -32.90 | kJ/mol | NIST |
ΔfusH° | 18.11 | kJ/mol | Heat Ca... |
ΔsubH° | [80.80; 80.90] | kJ/mol | |
ΔsubH° | 80.90 ± 1.50 | kJ/mol | NIST |
ΔsubH° | 80.80 ± 0.30 | kJ/mol | NIST |
ΔvapH° | 60.40 ± 0.30 | kJ/mol | NIST |
log10WS | [-2.55; -2.55] | ||
log10WS | -2.55 | Aq. Sol... | |
log10WS | -2.55 | Estimat... | |
logPoct/wat | 2.248 | Crippen Calculated Property | |
McVol | 101.300 | ml/mol | McGowan Calculated Property |
NFPA Fire | 1 | KDB | |
NFPA Health | 3 | KDB | |
NFPA Safety | 1 | KDB | |
Pc | 4426.72 | kPa | Joback Calculated Property |
Inp | [213.00; 1241.00] | ||
Inp | 1241.00 | NIST | |
Inp | 1195.00 | NIST | |
Inp | 1193.00 | NIST | |
Inp | 1199.00 | NIST | |
Inp | 213.00 | NIST | |
I | [1946.00; 1964.00] | ||
I | 1946.00 | NIST | |
I | 1964.00 | NIST | |
I | 1946.00 | NIST | |
Tboil | [519.15; 519.20] | K | |
Tboil | 519.20 | K | NIST |
Tboil | 519.15 ± 0.60 | K | NIST |
Tc | 817.38 | K | Joback Calculated Property |
Tfus | [305.15; 306.03] | K | |
Tfus | 306.03 | K | Aq. Sol... |
Tfus | 305.28 ± 0.07 | K | NIST |
Tfus | 305.28 ± 0.05 | K | NIST |
Tfus | 306.00 ± 1.50 | K | NIST |
Tfus | 305.15 ± 0.15 | K | NIST |
Tfus | 305.70 ± 1.50 | K | NIST |
Vc | 0.395 | m3/kmol | Joback Calculated Property |
Property | Value | Unit | Temperature (K) | Source |
---|---|---|---|---|
Cp,gas | [200.06; 243.57] | J/mol×K | [557.61; 817.38] | |
T(K) Ideal gas heat capacity (J/mol×K) 200 210 220 230 240 600 700 800 | ||||
Cp,gas | 200.06 | J/mol×K | 557.61 | Joback Calculated Property |
Cp,gas | 209.08 | J/mol×K | 600.91 | Joback Calculated Property |
Cp,gas | 217.33 | J/mol×K | 644.20 | Joback Calculated Property |
Cp,gas | 224.86 | J/mol×K | 687.50 | Joback Calculated Property |
Cp,gas | 231.72 | J/mol×K | 730.79 | Joback Calculated Property |
Cp,gas | 237.94 | J/mol×K | 774.09 | Joback Calculated Property |
Cp,gas | 243.57 | J/mol×K | 817.38 | Joback Calculated Property |
ΔfusH | [18.11; 19.08] | kJ/mol | [305.80; 308.20] | |
ΔfusH | 18.11 | kJ/mol | 305.80 | NIST |
ΔfusH | 18.21 | kJ/mol | 305.80 | NIST |
ΔfusH | 19.08 | kJ/mol | 308.20 | NIST |
ΔvapH | 52.10 | kJ/mol | 468.00 | NIST |
Property | Value | Unit | Pressure (kPa) | Source |
---|---|---|---|---|
Tboilr | 392.20 | K | 1.00 | NIST |
Property | Value | Unit | Temperature (K) | Source |
---|---|---|---|---|
Pvap | [1.33; 202.64] | kPa | [389.94; 550.26] | The Yaw... |
Equation | ln(Pvp) = A + B/(T + C) | |||
Coefficient A | 1.50943e+01 | |||
Coefficient B | -4.62238e+03 | |||
Coefficient C | -7.77630e+01 | |||
Temperature range, min. | 389.94 | |||
Temperature range, max. | 550.26 | |||
T(K) Vapor pressure (kPa) 0 50 100 150 200 400 450 500 550 | ||||
Pvap | 1.33 | kPa | 389.94 | Calculated Property |
Pvap | 2.96 | kPa | 407.75 | Calculated Property |
Pvap | 6.07 | kPa | 425.57 | Calculated Property |
Pvap | 11.61 | kPa | 443.38 | Calculated Property |
Pvap | 20.88 | kPa | 461.19 | Calculated Property |
Pvap | 35.66 | kPa | 479.01 | Calculated Property |
Pvap | 58.20 | kPa | 496.82 | Calculated Property |
Pvap | 91.25 | kPa | 514.63 | Calculated Property |
Pvap | 138.12 | kPa | 532.45 | Calculated Property |
Pvap | 202.64 | kPa | 550.26 | Calculated Property |
Pvap | [5.53e-03; 3908.14] | kPa | [306.15; 757.00] | KDB Vap... |
Equation | ln(Pvp) = A + B/T + C*ln(T) + D*T^2 | |||
Coefficient A | 1.11244e+02 | |||
Coefficient B | -1.20614e+04 | |||
Coefficient C | -1.35369e+01 | |||
Coefficient D | 4.71347e-06 | |||
Temperature range, min. | 306.15 | |||
Temperature range, max. | 757.00 | |||
T(K) Vapor pressure (kPa) 0 500 1000 1500 2000 2500 3000 3500 4000 400 600 | ||||
Pvap | 5.53e-03 | kPa | 306.15 | Calculated Property |
Pvap | 0.21 | kPa | 356.24 | Calculated Property |
Pvap | 2.77 | kPa | 406.34 | Calculated Property |
Pvap | 18.32 | kPa | 456.43 | Calculated Property |
Pvap | 76.65 | kPa | 506.53 | Calculated Property |
Pvap | 234.31 | kPa | 556.62 | Calculated Property |
Pvap | 574.75 | kPa | 606.72 | Calculated Property |
Pvap | 1205.37 | kPa | 656.81 | Calculated Property |
Pvap | 2259.48 | kPa | 706.91 | Calculated Property |
Pvap | 3908.14 | kPa | 757.00 | Calculated Property |
Find more compounds similar to Benzene, 1-chloro-2-nitro-.
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