Chemical Properties of Benzene, 1,3-dichloro- (CAS 541-73-1)

Benzene, 1,3-dichloro-

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InChI
InChI=1S/C6H4Cl2/c7-5-2-1-3-6(8)4-5/h1-4H
InChI Key
ZPQOPVIELGIULI-UHFFFAOYSA-N
Formula
C6H4Cl2
SMILES
Clc1cccc(Cl)c1
Molecular Weight1
147.00
CAS
541-73-1
Other Names
  • 1,3-DICHLOROBENZENE
  • Benzene, m-dichloro-
  • Metadichlorobenzene
  • Rcra waste number U071
  • m-Dichlorobenzene
  • m-Dichlorobenzol
  • m-Phenylene dichloride
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Physical Properties

Property Value Unit Source
Δcliquid [-2960.30; -2952.00] kJ/mol Show Hide
Δcliquid -2960.30 kJ/mol NIST
Δcliquid -2955.76 ± 0.96 kJ/mol NIST
Δcliquid -2952.00 ± 8.00 kJ/mol NIST
Δf 78.56 kJ/mol Joback Calculated Property
Δfgas 28.10 kJ/mol NIST
Δfliquid -20.50 ± 0.96 kJ/mol NIST
Δf(+) ion 903.30 kJ/mol NIST
ΔfH(+) ion,0K 915.90 kJ/mol NIST
Δfus 13.34 kJ/mol Joback Calculated Property
Δvap [47.00; 53.90] kJ/mol Show Hide
Δvap 53.90 kJ/mol NIST
Δvap 47.00 kJ/mol NIST
IE [9.10; 9.28] eV Show Hide
IE 9.10 ± 0.02 eV NIST
IE 9.10 ± 0.02 eV NIST
IE 9.14 ± 0.03 eV NIST
IE 9.26 eV NIST
IE 9.12 ± 0.02 eV NIST
IE 9.11 ± 0.01 eV NIST
IE 9.12 ± 0.01 eV NIST
IE 9.28 eV NIST
IE 9.15 eV NIST
log10WS [-3.05; -3.04]   Show Hide
log10WS -3.05 Aq. Sol...
log10WS -3.04 Estimat...
logPoct/wat 2.993 Crippen Calculated Property
McVol 96.120 ml/mol McGowan Calculated Property
NFPA Fire 2 KDB
NFPA Health 2 KDB
Pc 4151.61 kPa Joback Calculated Property
Inp [160.40; 1058.00]   Show Hide
Inp 1017.40 NIST
Inp 1020.06 NIST
Inp 1027.05 NIST
Inp 1027.35 NIST
Inp 1013.80 NIST
Inp 1022.50 NIST
Inp 1022.50 NIST
Inp 1036.20 NIST
Inp 1009.00 NIST
Inp 1024.65 NIST
Inp 1004.07 NIST
Inp 1013.30 NIST
Inp 985.00 NIST
Inp 964.00 NIST
Inp 1016.00 NIST
Inp 964.00 NIST
Inp 1013.00 NIST
Inp 1016.00 NIST
Inp 1058.00 NIST
Inp 1000.00 NIST
Inp 997.00 NIST
Inp 1022.00 NIST
Inp 1014.97 NIST
Inp 1015.34 NIST
Inp 1017.77 NIST
Inp 1018.92 NIST
Inp 975.40 NIST
Inp 1020.90 NIST
Inp 986.21 NIST
Inp 985.10 NIST
Inp 1002.37 NIST
Inp 997.98 NIST
Inp 999.87 NIST
Inp 1014.00 NIST
Inp 1002.00 NIST
Inp 990.00 NIST
Inp 985.00 NIST
Inp 982.00 NIST
Inp 1025.00 NIST
Inp 1004.00 NIST
Inp 997.00 NIST
Inp 1007.00 NIST
Inp 1005.00 NIST
Inp 1002.00 NIST
Inp 1011.00 NIST
Inp 1014.00 NIST
Inp 1022.00 NIST
Inp 964.00 NIST
Inp 988.00 NIST
Inp 1005.00 NIST
Inp 1047.00 NIST
Inp 986.00 NIST
Inp 982.00 NIST
Inp 1045.00 NIST
Inp 1021.00 NIST
Inp 981.00 NIST
Inp 981.00 NIST
Inp 981.00 NIST
Inp 982.00 NIST
Inp Outlier 162.00 NIST
Inp Outlier 160.40 NIST
Inp 1025.00 NIST
Inp 1004.00 NIST
Inp 1017.40 NIST
Inp 1022.50 NIST
Inp 1004.07 NIST
Inp 964.00 NIST
Inp 1000.00 NIST
Inp 1007.00 NIST
Inp Outlier 162.00 NIST
Inp 1022.00 NIST
Inp 975.40 NIST
Inp 997.98 NIST
Inp 985.00 NIST
Inp 1011.00 NIST
Inp 1005.00 NIST
Inp 1021.00 NIST
I [1409.00; 1477.00]   Show Hide
I 1455.40 NIST
I 1474.10 NIST
I 1415.00 NIST
I 1415.00 NIST
I 1434.00 NIST
I 1409.00 NIST
I 1414.00 NIST
I 1445.33 NIST
I 1438.32 NIST
I 1417.70 NIST
I 1446.00 NIST
I 1451.00 NIST
I 1453.00 NIST
I 1477.00 NIST
I 1418.00 NIST
I 1409.00 NIST
I 1455.40 NIST
I 1445.33 NIST
I 1453.00 NIST
I 1477.00 NIST
I 1418.00 NIST
Tboil [446.15; 446.20] K Show Hide
Tboil 446.15 K KDB
Tboil 446.15 K Excess ...
Tboil 446.20 K NIST
Tboil 446.15 ± 0.07 K NIST
Tc 674.86 K Joback Calculated Property
Tfus [246.90; 249.00] K Show Hide
Tfus 248.39 K KDB
Tfus 248.25 K Aq. Sol...
Tfus 248.39 ± 0.05 K NIST
Tfus 249.00 ± 2.00 K NIST
Tfus Outlier 246.90 ± 0.20 K NIST
Tfus 248.75 ± 0.50 K NIST
Vc 0.361 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [149.05; 190.77] J/mol×K [443.20; 674.86] Show Hide
Cp,gas 149.05 J/mol×K 443.20 Joback Calculated Property
Cp,gas 157.36 J/mol×K 481.81 Joback Calculated Property
Cp,gas 165.09 J/mol×K 520.42 Joback Calculated Property
Cp,gas 172.26 J/mol×K 559.03 Joback Calculated Property
Cp,gas 178.92 J/mol×K 597.64 Joback Calculated Property
Cp,gas 185.08 J/mol×K 636.25 Joback Calculated Property
Cp,gas 190.77 J/mol×K 674.86 Joback Calculated Property
Cp,liquid [167.15; 183.20] J/mol×K [283.15; 353.15] Show Hide
Cp,liquid 167.15 J/mol×K 283.15 Heat Ca...
Cp,liquid 167.54 J/mol×K 285.15 Heat Ca...
Cp,liquid 167.93 J/mol×K 287.15 Heat Ca...
Cp,liquid 168.32 J/mol×K 289.15 Heat Ca...
Cp,liquid 168.72 J/mol×K 291.15 Heat Ca...
Cp,liquid 169.13 J/mol×K 293.15 Heat Ca...
Cp,liquid 169.55 J/mol×K 295.15 Heat Ca...
Cp,liquid 169.97 J/mol×K 297.15 Heat Ca...
Cp,liquid 170.90 J/mol×K 298.15 NIST
Cp,liquid 170.39 J/mol×K 299.15 Heat Ca...
Cp,liquid 170.82 J/mol×K 301.15 Heat Ca...
Cp,liquid 171.25 J/mol×K 303.15 Heat Ca...
Cp,liquid 171.69 J/mol×K 305.15 Heat Ca...
Cp,liquid 172.14 J/mol×K 307.15 Heat Ca...
Cp,liquid 172.58 J/mol×K 309.15 Heat Ca...
Cp,liquid 173.04 J/mol×K 311.15 Heat Ca...
Cp,liquid 173.49 J/mol×K 313.15 Heat Ca...
Cp,liquid 173.95 J/mol×K 315.15 Heat Ca...
Cp,liquid 174.41 J/mol×K 317.15 Heat Ca...
Cp,liquid 174.88 J/mol×K 319.15 Heat Ca...
Cp,liquid 175.35 J/mol×K 321.15 Heat Ca...
Cp,liquid 175.83 J/mol×K 323.15 Heat Ca...
Cp,liquid 176.30 J/mol×K 325.15 Heat Ca...
Cp,liquid 176.78 J/mol×K 327.15 Heat Ca...
Cp,liquid 177.26 J/mol×K 329.15 Heat Ca...
Cp,liquid 177.75 J/mol×K 331.15 Heat Ca...
Cp,liquid 178.24 J/mol×K 333.15 Heat Ca...
Cp,liquid 178.73 J/mol×K 335.15 Heat Ca...
Cp,liquid 179.22 J/mol×K 337.15 Heat Ca...
Cp,liquid 179.71 J/mol×K 339.15 Heat Ca...
Cp,liquid 180.20 J/mol×K 341.15 Heat Ca...
Cp,liquid 180.70 J/mol×K 343.15 Heat Ca...
Cp,liquid 181.20 J/mol×K 345.15 Heat Ca...
Cp,liquid 181.70 J/mol×K 347.15 Heat Ca...
Cp,liquid 182.20 J/mol×K 349.15 Heat Ca...
Cp,liquid 182.70 J/mol×K 351.15 Heat Ca...
Cp,liquid 183.20 J/mol×K 353.15 Heat Ca...
η [0.0002989; 0.0021588] Pa×s [256.16; 443.20] Show Hide
η 0.0021588 Pa×s 256.16 Joback Calculated Property
η 0.0012985 Pa×s 287.33 Joback Calculated Property
η 0.0008628 Pa×s 318.51 Joback Calculated Property
η 0.0006166 Pa×s 349.68 Joback Calculated Property
η 0.0004656 Pa×s 380.85 Joback Calculated Property
η 0.0003668 Pa×s 412.03 Joback Calculated Property
η 0.0002989 Pa×s 443.20 Joback Calculated Property
ΔfusH [12.59; 12.64] kJ/mol [248.30; 248.75] Show Hide
ΔfusH 12.60 kJ/mol 248.30 NIST
ΔfusH 12.64 kJ/mol 248.40 NIST
ΔfusH 12.64 kJ/mol 248.40 NIST
ΔfusH 12.59 kJ/mol 248.75 NIST
ΔvapH [44.10; 50.40] kJ/mol [248.00; 430.50] Show Hide
ΔvapH 50.40 kJ/mol 248.00 NIST
ΔvapH 50.00 kJ/mol 262.00 NIST
ΔvapH 44.10 kJ/mol 402.50 NIST
ΔvapH 44.70 kJ/mol 430.50 NIST
n0 [1.53800; 1.54400]   [298.15; 308.15] Show Hide
n0 1.54400 298.15 Densiti...
n0 1.54320 298.15 Liquid-...
n0 1.54100 303.15 Densiti...
n0 1.53800 308.15 Densiti...
ρl [1277.16; 1282.87] kg/m3 [298.15; 303.15] Show Hide
ρl 1282.87 kg/m3 298.15 Experim...
ρl 1277.16 kg/m3 303.15 Effect ...
ΔfusS 50.60 J/mol×K 248.75 NIST

Datasets

Viscosity, Pa*s

Fixed Measured
Pressure, kPa - Liquid Temperature, K - Liquid Viscosity, Pa*s - Liquid
101.00 303.15 0.0010
Reference

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.64] kPa [324.41; 476.30] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.45419e+01
Coefficient B-3.97801e+03
Coefficient C-4.53350e+01
Temperature range, min.324.41
Temperature range, max.476.30
Pvap 1.33 kPa 324.41 Calculated Property
Pvap 3.01 kPa 341.29 Calculated Property
Pvap 6.21 kPa 358.16 Calculated Property
Pvap 11.90 kPa 375.04 Calculated Property
Pvap 21.41 kPa 391.92 Calculated Property
Pvap 36.49 kPa 408.79 Calculated Property
Pvap 59.30 kPa 425.67 Calculated Property
Pvap 92.49 kPa 442.55 Calculated Property
Pvap 139.10 kPa 459.42 Calculated Property
Pvap 202.64 kPa 476.30 Calculated Property
Pvap [6.34e-03; 4015.15] kPa [248.39; 683.95] KDB Vap... Show Hide
Equationln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A5.72737e+01
Coefficient B-7.22933e+03
Coefficient C-6.05176e+00
Coefficient D2.34995e-06
Temperature range, min.248.39
Temperature range, max.683.95
Pvap 6.34e-03 kPa 248.39 Calculated Property
Pvap 0.26 kPa 296.79 Calculated Property
Pvap 3.47 kPa 345.18 Calculated Property
Pvap 22.39 kPa 393.58 Calculated Property
Pvap 91.20 kPa 441.97 Calculated Property
Pvap 271.65 kPa 490.37 Calculated Property
Pvap 649.53 kPa 538.76 Calculated Property
Pvap 1325.74 kPa 587.16 Calculated Property
Pvap 2409.12 kPa 635.55 Calculated Property
Pvap 4015.15 kPa 683.95 Calculated Property

Similar Compounds

Benzene, chloro-. Benzene, 1,2-dichloro-. 1,2-Dichlorobenzene-D4. Benzene, 1,2,4-trichloro-. Benzene, 1,2,3-trichloro-. Benzene, 1,4-dichloro-. 1,4-Dichlorobenzene-D4. Benzene, 1,3,5-trichloro-. Benzene, 1,2,3,5-tetrachloro-. Benzene, 1,2,3,4-tetrachloro-. 1,3-Cyclohexadien-5-yne,1,4-dichloro-. 2,6-Dichloroiodobenzene. 2,4-Dichloroiodobenzene. Benzene, 1,2,4,5-tetrachloro-. 1,3-Dichloro-2-fluorobenzene.

Find more compounds similar to Benzene, 1,3-dichloro-.

Mixtures

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.