Mixture of (1R)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene + 2-Propanol + Water

(1R)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene

Name
(1R)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene
InChI
InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4,8-9H,5-6H2,1-3H3/t8-,9-/m1/s1
InChI Key
GRWFGVWFFZKLTI-RKDXNWHRSA-N
Formula
C10H16
SMILES
CC1=CC[C@@H]2C[C@H]1C2(C)C
Mol. Weight (g/mol)
136.24
CAS
7785-70-8

2-Propanol

Name
2-Propanol
InChI
InChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3
InChI Key
KFZMGEQAYNKOFK-UHFFFAOYSA-N
Formula
C3H8O
SMILES
CC(C)O
Mol. Weight (g/mol)
60.10
CAS
67-63-0

Water

Name
Water
InChI
InChI=1S/H2O/h1H2
InChI Key
XLYOFNOQVPJJNP-UHFFFAOYSA-N
Formula
H2O
SMILES
O
Mol. Weight (g/mol)
18.02
CAS
7732-18-5
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Datasets

  1. Temperature, K x Mass fraction

Temperature, K x Mass fraction [ref]

Operational condition: Pressure, kPa = 101 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 2 Mass fraction of Water (3) - Liquid mixture 2 Mass fraction of 2-Propanol (2) - Liquid mixture 2 Mass fraction of Water (3) - Liquid mixture 1 Mass fraction of 2-Propanol (2) - Liquid mixture 1
293.15 0.9774 0.0226 0.0000 0.0085
293.15 0.9613 0.0387 0.0000 0.0328
293.15 0.9291 0.0709 0.0000 0.0627
293.15 0.9083 0.0917 0.0052 0.0952
293.15 0.8737 0.1263 0.0126 0.1176
293.15 0.7827 0.2090 0.0204 0.1459
293.15 0.7246 0.2682 0.0316 0.1661
293.15 0.6958 0.2835 0.0406 0.1782
298.15 0.9637 0.0363 0.0000 0.0244
298.15 0.9311 0.0689 0.0086 0.0800
298.15 0.9019 0.0981 0.0174 0.1093
298.15 0.8727 0.1273 0.0206 0.1285
298.15 0.8166 0.1790 0.0249 0.1419
298.15 0.7545 0.2348 0.0271 0.1552
298.15 0.6816 0.2997 0.0335 0.1731
303.15 0.9659 0.0341 0.0000 0.0220
303.15 0.9358 0.0642 0.0000 0.0669
303.15 0.8795 0.1205 0.0249 0.1271
303.15 0.8231 0.1703 0.0258 0.1427
303.15 0.7627 0.2271 0.0317 0.1568
303.15 0.7414 0.2446 0.0330 0.1641
303.15 0.7077 0.2723 0.0453 0.1761
303.15 0.6850 0.2911 0.0469 0.1770
308.15 0.9653 0.0347 0.0000 0.0205
308.15 0.8750 0.1250 0.0229 0.1258
308.15 0.8460 0.1540 0.0218 0.1250
308.15 0.8125 0.1825 0.0222 0.1383
308.15 0.7641 0.2272 0.0295 0.1473
308.15 0.7331 0.2524 0.0299 0.1594
308.15 0.7061 0.2738 0.0355 0.1675

Sources

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