Chemical Properties of Cyclohexane, 1,3-dimethyl-, cis- (CAS 638-04-0)

Cyclohexane, 1,3-dimethyl-, cis-

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InChI
InChI=1S/C8H16/c1-7-4-3-5-8(2)6-7/h7-8H,3-6H2,1-2H3/t7-,8+
InChI Key
SGVUHPSBDNVHKL-OCAPTIKFSA-N
Formula
C8H16
SMILES
CC1CCCC(C)C1
Molecular Weight1
112.21
CAS
638-04-0
Other Names
  • 1,3-Dimethylcyclohexane, cis-
  • 1,3-dimethyl(cis)-cyclohexane
  • 1,CIS-3-DIMETHYLCYCLOHEXANE
  • CIS-1,3-DIMETHYLCYCLOHEXANE
  • Cyclohexane, cis-1,3-dimethyl-
  • NSC 74159
  • c-1,3-Dimethylcyclohexane

Physical Properties

Property Value Unit Source
ω 0.2240 KDB
AP 324.850 K KDB
Δcliquid -5211.80 ± 1.70 kJ/mol NIST
Δf 29.85 kJ/mol KDB
Δc,grossH 5211.80 kJ/mol KDB
Δc,netH 4859.716 kJ/mol KDB
Δfgas -184.90 kJ/mol KDB
Δfus 9.38 kJ/mol Joback Calculated Property
Δvap [38.10; 38.31] kJ/mol Show Hide
Δvap 38.31 kJ/mol NIST
Δvap 38.10 kJ/mol NIST
Δvap 38.20 kJ/mol NIST
Δvap 38.20 ± 0.10 kJ/mol NIST
Δvap 38.22 kJ/mol NIST
IE 9.98 ± 0.05 eV NIST
log10WS -2.58 Crippen Calculated Property
logPoct/wat 2.833 Crippen Calculated Property
McVol 112.720 ml/mol McGowan Calculated Property
Pc 2900.00 kPa KDB
Inp [764.00; 804.00]   Show Hide
Inp Outlier 764.00 NIST
Inp 778.40 NIST
Inp 778.50 NIST
Inp 778.60 NIST
Inp 778.10 NIST
Inp 774.90 NIST
Inp 780.30 NIST
Inp 785.00 NIST
Inp 789.80 NIST
Inp 772.00 NIST
Inp 777.00 NIST
Inp 782.00 NIST
Inp 788.00 NIST
Inp 784.70 NIST
Inp 784.70 NIST
Inp 789.60 NIST
Inp 773.30 NIST
Inp 775.50 NIST
Inp 777.90 NIST
Inp 780.20 NIST
Inp 785.10 NIST
Inp 770.00 NIST
Inp 772.00 NIST
Inp 774.00 NIST
Inp 777.00 NIST
Inp 780.00 NIST
Inp 782.00 NIST
Inp 778.40 NIST
Inp 778.60 NIST
Inp Outlier 804.00 NIST
Inp 784.90 NIST
Inp 789.70 NIST
Inp 789.70 NIST
Inp 790.10 NIST
Inp 790.80 NIST
Inp 790.80 NIST
Inp 785.00 NIST
Inp 790.00 NIST
Inp 785.00 NIST
Inp 788.00 NIST
Inp 789.00 NIST
Inp 792.00 NIST
Inp 795.00 NIST
Inp 785.00 NIST
Inp 785.00 NIST
Inp Outlier 798.00 NIST
Inp 783.00 NIST
Inp 789.00 NIST
Inp 770.00 NIST
Inp Outlier 798.00 NIST
Inp 769.80 NIST
Inp 778.00 NIST
Inp 776.60 NIST
Inp 772.80 NIST
Inp 774.70 NIST
Inp 776.60 NIST
Inp 783.30 NIST
Inp 775.00 NIST
Inp 772.80 NIST
Inp 774.70 NIST
Inp 776.60 NIST
Inp 770.23 NIST
Inp 771.54 NIST
Inp 771.77 NIST
Inp 772.00 NIST
Inp 767.70 NIST
Inp 770.50 NIST
Inp 772.28 NIST
Inp 771.53 NIST
Inp 774.44 NIST
Inp 776.29 NIST
Inp 770.00 NIST
Inp 785.32 NIST
Inp 790.00 NIST
Inp 778.00 NIST
Inp 773.00 NIST
Inp 778.00 NIST
Inp 773.00 NIST
Inp 773.00 NIST
Inp 784.40 NIST
Inp 786.00 NIST
Inp 788.50 NIST
Inp 790.50 NIST
Inp 792.20 NIST
Inp 793.70 NIST
Inp 785.00 NIST
Inp Outlier 764.00 NIST
Inp 785.32 NIST
Inp 785.00 NIST
Inp 790.00 NIST
Inp 770.00 NIST
Inp 769.80 NIST
I [810.00; 810.00]   Show Hide
I 810.00 NIST
I 810.00 NIST
gas 371.20 J/mol×K NIST
liquid 272.63 J/mol×K NIST
Tboil [392.15; 398.10] K Show Hide
Tboil 393.30 K KDB
Tboil 393.20 K NIST
Tboil 393.30 K NIST
Tboil 393.50 ± 0.30 K NIST
Tboil 393.70 ± 0.50 K NIST
Tboil 393.00 ± 2.00 K NIST
Tboil 393.56 ± 0.30 K NIST
Tboil 393.20 ± 1.00 K NIST
Tboil 392.15 ± 0.50 K NIST
Tboil 393.65 ± 0.50 K NIST
Tboil 393.85 ± 0.60 K NIST
Tboil 393.15 ± 0.10 K NIST
Tboil 394.15 ± 0.60 K NIST
Tboil 393.75 ± 0.50 K NIST
Tboil 393.23 ± 0.02 K NIST
Tboil 393.45 ± 0.30 K NIST
Tboil 393.24 ± 0.20 K NIST
Tboil Outlier 397.85 ± 0.30 K NIST
Tboil 392.65 ± 0.50 K NIST
Tboil 392.70 ± 2.00 K NIST
Tboil 392.65 ± 0.50 K NIST
Tboil Outlier 398.10 ± 2.00 K NIST
Tboil 393.15 ± 0.70 K NIST
Tboil 393.55 ± 0.30 K NIST
Tboil 394.70 ± 2.00 K NIST
Tc [591.00; 591.00] K Show Hide
Tc 591.00 K KDB
Tc 591.00 K NIST
Tfus [177.95; 197.60] K Show Hide
Tfus 197.60 K KDB
Tfus 196.09 ± 0.02 K NIST
Tfus 177.95 ± 0.20 K NIST
Tfus 194.15 ± 3.00 K NIST
Ttriple [197.58; 197.59] K Show Hide
Ttriple 197.59 ± 0.02 K NIST
Ttriple 197.58 ± 0.05 K NIST
Ttriple 197.59 ± 0.03 K NIST
Vc 0.449 m3/kmol KDB
Zc 0.2649250 KDB

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [212.54; 307.47] J/mol×K [397.32; 597.67] Show Hide
Cp,gas 212.54 J/mol×K 397.32 Joback Calculated Property
Cp,gas 230.28 J/mol×K 430.71 Joback Calculated Property
Cp,gas 247.23 J/mol×K 464.10 Joback Calculated Property
Cp,gas 263.41 J/mol×K 497.49 Joback Calculated Property
Cp,gas 278.84 J/mol×K 530.89 Joback Calculated Property
Cp,gas 293.52 J/mol×K 564.28 Joback Calculated Property
Cp,gas 307.47 J/mol×K 597.67 Joback Calculated Property
Cp,liquid 209.37 J/mol×K 298.15 NIST
η [0.0002631; 0.0041986] Pa×s [183.06; 397.32] Show Hide
η 0.0041986 Pa×s 183.06 Joback Calculated Property
η 0.0018154 Pa×s 218.77 Joback Calculated Property
η 0.0009932 Pa×s 254.48 Joback Calculated Property
η 0.0006303 Pa×s 290.19 Joback Calculated Property
η 0.0004419 Pa×s 325.90 Joback Calculated Property
η 0.0003324 Pa×s 361.61 Joback Calculated Property
η 0.0002631 Pa×s 397.32 Joback Calculated Property
ΔfusH [10.82; 10.82] kJ/mol [197.59; 197.60] Show Hide
ΔfusH 10.82 kJ/mol 197.59 NIST
ΔfusH 10.82 kJ/mol 197.60 NIST
ΔfusH 10.82 kJ/mol 197.60 NIST
ΔvapH [32.80; 37.70] kJ/mol [357.00; 393.30] Show Hide
ΔvapH 36.80 kJ/mol 357.00 NIST
ΔvapH 37.70 kJ/mol 357.00 NIST
ΔvapH 34.90 ± 0.10 kJ/mol 363.00 NIST
ΔvapH 33.30 ± 0.10 kJ/mol 385.00 NIST
ΔvapH 32.80 kJ/mol 393.30 KDB
ΔvapH 32.91 kJ/mol 393.30 NIST
n0 1.42063 298.15 KDB
ρl 766.00 kg/m3 293.00 KDB
ΔfusS 54.77 J/mol×K 197.59 NIST
γ 0.02 N/m 293.20 KDB

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.63] kPa [283.11; 420.90] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.38755e+01
Coefficient B-3.19163e+03
Coefficient C-4.82270e+01
Temperature range, min.283.11
Temperature range, max.420.90
Pvap 1.33 kPa 283.11 Calculated Property
Pvap 3.06 kPa 298.42 Calculated Property
Pvap 6.39 kPa 313.73 Calculated Property
Pvap 12.30 kPa 329.04 Calculated Property
Pvap 22.14 kPa 344.35 Calculated Property
Pvap 37.61 kPa 359.66 Calculated Property
Pvap 60.80 kPa 374.97 Calculated Property
Pvap 94.13 kPa 390.28 Calculated Property
Pvap 140.40 kPa 405.59 Calculated Property
Pvap 202.63 kPa 420.90 Calculated Property
Pvap [5.63e-04; 2938.63] kPa [197.58; 591.15] KDB Vap... Show Hide
Equationln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A7.27551e+01
Coefficient B-6.92278e+03
Coefficient C-8.58765e+00
Coefficient D5.00269e-06
Temperature range, min.197.58
Temperature range, max.591.15
Pvap 5.63e-04 kPa 197.58 Calculated Property
Pvap 0.06 kPa 241.31 Calculated Property
Pvap 1.39 kPa 285.04 Calculated Property
Pvap 11.83 kPa 328.77 Calculated Property
Pvap 55.91 kPa 372.50 Calculated Property
Pvap 180.47 kPa 416.23 Calculated Property
Pvap 450.62 kPa 459.96 Calculated Property
Pvap 942.18 kPa 503.69 Calculated Property
Pvap 1739.08 kPa 547.42 Calculated Property
Pvap 2938.63 kPa 591.15 Calculated Property

Similar Compounds

Cyclohexane, 1,3-dimethyl-, trans-. Cyclohexane, 1,3-dimethyl-. trans-1,3-Dimethylcyclooctane. cis-1,3-Dimethylcyclooctane. Cyclohexane, 1-(cyclohexylmethyl)-3-methyl-, cis-. Cyclohexane, 1,1'-(2-methyl-1,3-propanediyl)bis-. Cyclohexane, (2-methylpropyl)-. Cyclohexane, 1-(cyclohexylmethyl)-3-methyl-, trans-. cis-1,3-Dimethylcycloheptane. Heptane, 2,4-dimethyl-. trans-1,3-Dimethylcycloheptane. Cyclohexane, 1-(cyclohexylmethyl)-4-methyl-, trans-. Cyclohexane, 1-(cyclohexylmethyl)-4-methyl-, cis-. 2,4-dimethylnonane. 2,4-Dimethyldodecane.

Find more compounds similar to Cyclohexane, 1,3-dimethyl-, cis-.

Sources

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