Mixture of 1-Butanol, 3-methyl- + Abietic acid

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1-Butanol, 3-methyl-

Name
1-Butanol, 3-methyl-
InChI
InChI=1S/C5H12O/c1-5(2)3-4-6/h5-6H,3-4H2,1-2H3
InChI Key
PHTQWCKDNZKARW-UHFFFAOYSA-N
Formula
C5H12O
SMILES
CC(C)CCO
Mol. Weight (g/mol)
88.15
CAS
123-51-3

Abietic acid

Name
Abietic acid
InChI
InChI=1S/C20H30O2/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22/h7,12-13,16-17H,5-6,8-11H2,1-4H3,(H,21,22)/t16?,17?,19?,20-/m0/s1
InChI Key
RSWGJHLUYNHPMX-CSPVLLTOSA-N
Formula
C20H30O2
SMILES
CC(C)C1=CC2=CCC3C(C)(C(=O)O)CCCC3(C)C2CC1
Mol. Weight (g/mol)
302.45
CAS
514-10-3
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Datasets

  1. Tfus - Solid-liquid equilibrium temperature, K (2)

Solid-liquid equilibrium temperature, K [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Mole fraction of Abietic acid (2) - Liquid Solid-liquid equilibrium temperature, K - Liquid
0.0495 288.80
0.0538 292.37
0.0563 294.70
0.0589 296.55
0.0615 298.60
0.0642 300.83
0.0698 304.05
0.0726 306.30
0.0759 308.15
0.0819 311.55
0.0874 314.35
0.0934 317.36
0.0996 320.23
0.1060 322.80

Solid-liquid equilibrium temperature, K [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Mole fraction of Abietic acid (2) - Liquid Solid-liquid equilibrium temperature, K - Liquid
0.0495 288.80
0.0538 292.37
0.0563 294.70
0.0589 296.55
0.0615 298.60
0.0642 300.83
0.0698 304.05
0.0726 306.30
0.0759 308.15
0.0819 311.55
0.0874 314.35
0.0934 317.36
0.0996 320.23
0.1060 322.80

Sources