Chemical Properties of Heptane, 3-(chloromethyl)- (CAS 123-04-6)

Heptane, 3-(chloromethyl)-

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InChI
InChI=1S/C8H17Cl/c1-3-5-6-8(4-2)7-9/h8H,3-7H2,1-2H3
InChI Key
WLVCBAMXYMWGLJ-UHFFFAOYSA-N
Formula
C8H17Cl
SMILES
CCCCC(CC)CCl
Molecular Weight1
148.67
CAS
123-04-6
Other Names
  • 1-Chloro-2-ethylhexane
  • 2-Ethylhexyl chloride
  • 3-(Chloromethyl)heptane
  • hexane, 1-chloro-2-ethyl-
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Physical Properties

Property Value Unit Source
Δf 2.11 kJ/mol Joback Calculated Property
Δfgas -229.47 kJ/mol Joback Calculated Property
Δfus 17.15 kJ/mol Joback Calculated Property
Δvap 37.40 kJ/mol Joback Calculated Property
log10WS -3.08 Crippen Calculated Property
logPoct/wat 3.442 Crippen Calculated Property
McVol 135.820 ml/mol McGowan Calculated Property
Pc 2462.92 kPa Joback Calculated Property
Tboil 445.40 K Isobari...
Tc 594.11 K Joback Calculated Property
Tfus 194.84 K Joback Calculated Property
Vc 0.526 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [262.83; 334.03] J/mol×K [419.43; 594.11] Show Hide
Cp,gas 262.83 J/mol×K 419.43 Joback Calculated Property
Cp,gas 275.97 J/mol×K 448.54 Joback Calculated Property
Cp,gas 288.58 J/mol×K 477.66 Joback Calculated Property
Cp,gas 300.68 J/mol×K 506.77 Joback Calculated Property
Cp,gas 312.27 J/mol×K 535.88 Joback Calculated Property
Cp,gas 323.39 J/mol×K 564.99 Joback Calculated Property
Cp,gas 334.03 J/mol×K 594.11 Joback Calculated Property
η [0.0002677; 0.0088497] Pa×s [194.84; 419.43] Show Hide
η 0.0088497 Pa×s 194.84 Joback Calculated Property
η 0.0030882 Pa×s 232.27 Joback Calculated Property
η 0.0014434 Pa×s 269.70 Joback Calculated Property
η 0.0008121 Pa×s 307.13 Joback Calculated Property
η 0.0005177 Pa×s 344.57 Joback Calculated Property
η 0.0003605 Pa×s 382.00 Joback Calculated Property
η 0.0002677 Pa×s 419.43 Joback Calculated Property
ΔvapH 44.20 kJ/mol 407.00 NIST
n0 [1.43260; 1.43260]   [293.10; 293.10] Show Hide
n0 1.43260 293.10 Phase E...
n0 1.43260 293.10 Vapor-L...

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.64] kPa [337.12; 479.79] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.48971e+01
Coefficient B-3.97698e+03
Coefficient C-6.49020e+01
Temperature range, min.337.12
Temperature range, max.479.79
Pvap 1.33 kPa 337.12 Calculated Property
Pvap 2.98 kPa 352.97 Calculated Property
Pvap 6.12 kPa 368.82 Calculated Property
Pvap 11.71 kPa 384.68 Calculated Property
Pvap 21.07 kPa 400.53 Calculated Property
Pvap 35.95 kPa 416.38 Calculated Property
Pvap 58.58 kPa 432.23 Calculated Property
Pvap 91.68 kPa 448.09 Calculated Property
Pvap 138.47 kPa 463.94 Calculated Property
Pvap 202.64 kPa 479.79 Calculated Property

Similar Compounds

2-Ethyl-1,10-dichloro decane. Heptane, 1-chloro-2-methyl. Hexane, 1-chloro-2-methyl. Pentane, 1-chloro-2-methyl. 1-Chloro-6-methylheptane. Pentane, 3-(chloromethyl). Hexane, 1-chloro-5-methyl-. 3-Cyclohexyl-1-chloropropane. 2-Chloroadamantane. Bicyclo[2.2.2]octane, 2-chloro-. Cyclohexane, 2-chloro-4-methyl-1-(1-methylethyl)-, [1S-(1«alpha»,2«beta»,4«beta»)]-. 1-Chloro-4-methylcyclohexane. Bicyclo[2.2.1]heptane, 2-chloro-. Bicyclo[2.2.1]heptane, 2-chloro-, exo-. Heptane, 2-chloro-6-methyl-.

Find more compounds similar to Heptane, 3-(chloromethyl)-.

Mixtures

Sources

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