Mixture of Toluene + Heptane + Thiophene, tetrahydro-, 1,1-dioxide

Excel

Toluene

Name
Toluene
InChI
InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3
InChI Key
YXFVVABEGXRONW-UHFFFAOYSA-N
Formula
C7H8
SMILES
Cc1ccccc1
Mol. Weight (g/mol)
92.14
CAS
108-88-3

Heptane

Name
Heptane
InChI
InChI=1S/C7H16/c1-3-5-7-6-4-2/h3-7H2,1-2H3
InChI Key
IMNFDUFMRHMDMM-UHFFFAOYSA-N
Formula
C7H16
SMILES
CCCCCCC
Mol. Weight (g/mol)
100.20
CAS
142-82-5

Thiophene, tetrahydro-, 1,1-dioxide

Name
Thiophene, tetrahydro-, 1,1-dioxide
InChI
InChI=1S/C4H8O2S/c5-7(6)3-1-2-4-7/h1-4H2
InChI Key
HXJUTPCZVOIRIF-UHFFFAOYSA-N
Formula
C4H8O2S
SMILES
O=S1(=O)CCCC1
Mol. Weight (g/mol)
120.17
CAS
126-33-0
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Datasets

  1. Temperature, K x Mole fraction (4)

Temperature, K x Mole fraction [ref]

Operational condition: Pressure, kPa = 100 (Liquid mixture 1)

Fixed Measured
Temperature, K - Liquid mixture 1 Mole fraction of Toluene (1) - Liquid mixture 1 Mole fraction of Heptane (2) - Liquid mixture 1 Mole fraction of Heptane (2) - Liquid mixture 2 Mole fraction of Toluene (1) - Liquid mixture 2
313.20 0.0335 0.9628 0.0088 0.0095
313.20 0.0591 0.9318 0.0095 0.0186
313.20 0.0845 0.9114 0.0102 0.0279
313.20 0.1149 0.8798 0.0099 0.0342
313.20 0.1503 0.8439 0.0118 0.0516
313.20 0.1772 0.8159 0.0102 0.0522
313.20 0.2521 0.7334 0.0139 0.0915
313.20 0.3064 0.6812 0.0156 0.1145
313.20 0.4142 0.5665 0.0173 0.1612
313.20 0.5149 0.4585 0.0213 0.2254
313.20 0.6001 0.3594 0.0261 0.2924
313.20 0.6437 0.3006 0.0333 0.3301
348.20 0.0330 0.9603 0.0121 0.0104
348.20 0.0967 0.8942 0.0155 0.0317
348.20 0.1178 0.8731 0.0153 0.0376
348.20 0.1878 0.7967 0.0160 0.0614
348.20 0.1922 0.7953 0.0172 0.0675
348.20 0.2506 0.7335 0.0180 0.0855
348.20 0.3005 0.6805 0.0207 0.1081
348.20 0.4073 0.5661 0.0214 0.1590
348.20 0.5032 0.4524 0.0272 0.2305
348.20 0.5933 0.3456 0.0375 0.3119
348.20 0.6274 0.2924 0.0443 0.3529

Temperature, K x Mole fraction [ref]

Operational condition: Pressure, kPa = 101.32 (Liquid mixture 1)

Fixed Measured
Temperature, K - Liquid mixture 1 Mole fraction of Heptane (2) - Liquid mixture 1 Mole fraction of Toluene (1) - Liquid mixture 1 Mole fraction of Heptane (2) - Liquid mixture 2 Mole fraction of Toluene (1) - Liquid mixture 2
298.15 0.9992 0.0000 0.0048 0.0000
298.15 0.8708 0.1244 0.0093 0.0383
298.15 0.7723 0.2188 0.0107 0.0784
298.15 0.6954 0.2928 0.0120 0.1170
298.15 0.5963 0.3842 0.0152 0.1724
298.15 0.5452 0.4329 0.0190 0.2143
298.15 0.4453 0.5152 0.0226 0.2679
298.15 0.2820 0.6141 0.0414 0.4183
298.15 0.1774 0.6359 0.0744 0.5334
323.15 0.9958 0.0000 0.0120 0.0000
323.15 0.8853 0.1091 0.0192 0.0336
323.15 0.7778 0.2140 0.0208 0.0749
323.15 0.6644 0.3209 0.0229 0.1402
323.15 0.5712 0.4032 0.0262 0.1898
323.15 0.4607 0.4964 0.0388 0.2506
323.15 0.3693 0.5564 0.0545 0.3398
323.15 0.3012 0.5893 0.0694 0.3986
323.15 0.2359 0.5955 0.1160 0.4979
348.15 0.9925 0.0000 0.0203 0.0000
348.15 0.9004 0.0830 0.0263 0.0250
348.15 0.7869 0.1950 0.0305 0.0752
348.15 0.6936 0.2821 0.0324 0.1210
348.15 0.5809 0.3786 0.0404 0.1808
348.15 0.5008 0.4421 0.0477 0.2426
348.15 0.4043 0.5028 0.0614 0.3267
348.15 0.3281 0.5429 0.0792 0.4011
348.15 0.2457 0.5657 0.1112 0.4800
373.15 0.9898 0.0000 0.0322 0.0000
373.15 0.8974 0.0921 0.0340 0.0301
373.15 0.8210 0.1614 0.0366 0.0592
373.15 0.7271 0.2436 0.0410 0.1021
373.15 0.6409 0.3129 0.0468 0.1487
373.15 0.5676 0.3686 0.0537 0.1942
373.15 0.4977 0.4151 0.0637 0.2417
373.15 0.4251 0.4568 0.0769 0.2964
373.15 0.3356 0.4920 0.1016 0.3686

Temperature, K x Mole fraction [ref]

Operational condition: Pressure, kPa = 100 (Liquid mixture 1)

Fixed Measured
Temperature, K - Liquid mixture 1 Mole fraction of Toluene (1) - Liquid mixture 1 Mole fraction of Heptane (2) - Liquid mixture 1 Mole fraction of Heptane (2) - Liquid mixture 2 Mole fraction of Toluene (1) - Liquid mixture 2
313.20 0.0335 0.9628 0.0088 0.0095
313.20 0.0591 0.9318 0.0095 0.0186
313.20 0.0845 0.9114 0.0102 0.0279
313.20 0.1149 0.8798 0.0099 0.0342
313.20 0.1503 0.8439 0.0118 0.0516
313.20 0.1772 0.8159 0.0102 0.0522
313.20 0.2521 0.7334 0.0139 0.0915
313.20 0.3064 0.6812 0.0156 0.1145
313.20 0.4142 0.5665 0.0173 0.1612
313.20 0.5149 0.4585 0.0213 0.2254
313.20 0.6001 0.3594 0.0261 0.2924
313.20 0.6437 0.3006 0.0333 0.3301
348.20 0.0330 0.9603 0.0121 0.0104
348.20 0.0967 0.8942 0.0155 0.0317
348.20 0.1178 0.8731 0.0153 0.0376
348.20 0.1878 0.7967 0.0160 0.0614
348.20 0.1922 0.7953 0.0172 0.0675
348.20 0.2506 0.7335 0.0180 0.0855
348.20 0.3005 0.6805 0.0207 0.1081
348.20 0.4073 0.5661 0.0214 0.1590
348.20 0.5032 0.4524 0.0272 0.2305
348.20 0.5933 0.3456 0.0375 0.3119
348.20 0.6274 0.2924 0.0443 0.3529

Temperature, K x Mole fraction [ref]

Operational condition: Pressure, kPa = 101.32 (Liquid mixture 1)

Fixed Measured
Temperature, K - Liquid mixture 1 Mole fraction of Heptane (2) - Liquid mixture 1 Mole fraction of Toluene (1) - Liquid mixture 1 Mole fraction of Heptane (2) - Liquid mixture 2 Mole fraction of Toluene (1) - Liquid mixture 2
298.15 0.9992 0.0000 0.0048 0.0000
298.15 0.8708 0.1244 0.0093 0.0383
298.15 0.7723 0.2188 0.0107 0.0784
298.15 0.6954 0.2928 0.0120 0.1170
298.15 0.5963 0.3842 0.0152 0.1724
298.15 0.5452 0.4329 0.0190 0.2143
298.15 0.4453 0.5152 0.0226 0.2679
298.15 0.2820 0.6141 0.0414 0.4183
298.15 0.1774 0.6359 0.0744 0.5334
323.15 0.9958 0.0000 0.0120 0.0000
323.15 0.8853 0.1091 0.0192 0.0336
323.15 0.7778 0.2140 0.0208 0.0749
323.15 0.6644 0.3209 0.0229 0.1402
323.15 0.5712 0.4032 0.0262 0.1898
323.15 0.4607 0.4964 0.0388 0.2506
323.15 0.3693 0.5564 0.0545 0.3398
323.15 0.3012 0.5893 0.0694 0.3986
323.15 0.2359 0.5955 0.1160 0.4979
348.15 0.9925 0.0000 0.0203 0.0000
348.15 0.9004 0.0830 0.0263 0.0250
348.15 0.7869 0.1950 0.0305 0.0752
348.15 0.6936 0.2821 0.0324 0.1210
348.15 0.5809 0.3786 0.0404 0.1808
348.15 0.5008 0.4421 0.0477 0.2426
348.15 0.4043 0.5028 0.0614 0.3267
348.15 0.3281 0.5429 0.0792 0.4011
348.15 0.2457 0.5657 0.1112 0.4800
373.15 0.9898 0.0000 0.0322 0.0000
373.15 0.8974 0.0921 0.0340 0.0301
373.15 0.8210 0.1614 0.0366 0.0592
373.15 0.7271 0.2436 0.0410 0.1021
373.15 0.6409 0.3129 0.0468 0.1487
373.15 0.5676 0.3686 0.0537 0.1942
373.15 0.4977 0.4151 0.0637 0.2417
373.15 0.4251 0.4568 0.0769 0.2964
373.15 0.3356 0.4920 0.1016 0.3686

Sources