Chemical Properties of Benzene, 1-chloro-2-(chloromethyl)- (CAS 611-19-8)

Benzene, 1-chloro-2-(chloromethyl)-

InChI
InChI=1S/C7H6Cl2/c8-5-6-3-1-2-4-7(6)9/h1-4H,5H2
InChI Key
BASMANVIUSSIIM-UHFFFAOYSA-N
Formula
C7H6Cl2
SMILES
ClCc1ccccc1Cl
Molecular Weight1
161.03
CAS
611-19-8
Other Names
  • 1-Chloro-2-(chloromethyl)benzene
  • 2,alpha-Dichlorotoluene
  • 2,«alpha»-Dichlorotoluene
  • 2-Chlorobenzyl chloride
  • NSC 8446
  • Ortho-«alpha»-dichlorotoluene
  • Toluene, o,«alpha»-dichloro-
  • alpha,o-Dichlorotoluene
  • o,«alpha»-dichlorotoluene
  • o-Chlorobenzyl chloride
  • «alpha»,2-Dichlorotoluene
  • «alpha»,o-Dichlorotoluene
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Physical Properties

Property Value Unit Source
ω 0.3410 Relay (1.0) Calculated Property
ΔfG° 86.98 kJ/mol Joback Calculated Property
ΔfH°gas -10.05 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 15.93 kJ/mol Joback Calculated Property
ΔvapH° 55.79 kJ/mol Relay (1.0) Calculated Property
IE 9.10 eV Relay (1.0) Calculated Property
log10WS -3.11 Relay (1.0) Calculated Property
logPoct/wat 3.079 Crippen Calculated Property
McVol 110.210 ml/mol McGowan Calculated Property
Pc 3682.02 kPa Joback Calculated Property
Tboil 486.70 K NIST
Tc 724.71 K Relay (1.0) Calculated Property
Tfus 281.30 K Relay (1.0) Calculated Property
Vc 0.396 m3/kmol Relay (1.0) Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [126.08; 275.44] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A2.70100e+00
Coefficient B5.44000e-01
Coefficient C-3.61960e-04
Coefficient D9.07000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 126.08 J/mol×K 273.00 Calculated Property
Cp,gas 153.87 J/mol×K 353.78 Calculated Property
Cp,gas 178.19 J/mol×K 434.56 Calculated Property
Cp,gas 199.33 J/mol×K 515.33 Calculated Property
Cp,gas 217.58 J/mol×K 596.11 Calculated Property
Cp,gas 233.22 J/mol×K 676.89 Calculated Property
Cp,gas 246.53 J/mol×K 757.67 Calculated Property
Cp,gas 257.82 J/mol×K 838.44 Calculated Property
Cp,gas 267.36 J/mol×K 919.22 Calculated Property
Cp,gas 275.44 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0022622; 0.0002565] Pa×s [267.43; 486.08] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-1.09314e+01
Coefficient B1.29436e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
CommentLiquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.267.43
Temperature range, max.486.08
η 0.0022622 Pa×s 267.43 Calculated Property
η 0.0015118 Pa×s 291.72 Calculated Property
η 0.0010749 Pa×s 316.02 Calculated Property
η 0.0008024 Pa×s 340.31 Calculated Property
η 0.0006227 Pa×s 364.61 Calculated Property
η 0.0004989 Pa×s 388.90 Calculated Property
η 0.0004102 Pa×s 413.19 Calculated Property
η 0.0003447 Pa×s 437.49 Calculated Property
η 0.0002950 Pa×s 461.78 Calculated Property
η 0.0002565 Pa×s 486.08 Calculated Property
Property Value Unit Temperature (K) Source
Pvap [1.33; 202.65] kPa [359.62; 518.49] The Yaws Handbook of Vapor Pressure Show Hide
Equationln(Y) = A + B/(T + C)
Y is Pvap in kPa, T in K
Coefficient A1.42356e+01
Coefficient B-3.93626e+03
Coefficient C-7.74120e+01
Temperature range, min.359.62
Temperature range, max.518.49
Pvap 1.33 kPa 359.62 Calculated Property
Pvap 3.03 kPa 377.27 Calculated Property
Pvap 6.29 kPa 394.92 Calculated Property
Pvap 12.08 kPa 412.58 Calculated Property
Pvap 21.74 kPa 430.23 Calculated Property
Pvap 36.99 kPa 447.88 Calculated Property
Pvap 59.97 kPa 465.53 Calculated Property
Pvap 93.23 kPa 483.19 Calculated Property
Pvap 139.69 kPa 500.84 Calculated Property
Pvap 202.65 kPa 518.49 Calculated Property

Similar Compounds

Benzene, 2,4-dichloro-1-(chloromethyl)-. [2H8]-2-Chloro-1-(Chloromethyl)-4-methylbenzene. Benzene, 2-chloro-1,4-bis-(chloromethyl). Benzene, 4-chloro-3-(chloromethyl)-1-methyl. Benzene, 1,3-dichloro-2-(chloromethyl)-. Benzene, 1-chloro-3-(chloromethyl)-. 3-Chloro-4-methylbenzyl chloride. [2H8]-3-Chloro-1-(Chloromethyl)-4-methylbenzene. Benzene, 1-chloro-2-methyl-. chlorotoluene. Benzene, 2-chloro-5-(chloromethyl)-1-methyl. 1,2,4-trichloro-5-(chloromethyl)benzene. Benzene, 1,3-dichloro-2-(dichloromethyl)-. Benzene, 1-chloro-3-(dichloromethyl)-. Benzene, 1,2-dichloro-4-(chloromethyl)-.

Find more compounds similar to Benzene, 1-chloro-2-(chloromethyl)-.

Sources

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