Mixture of 1-Butanol, 3-methyl- + 1-Butanol, 3-methyl-, acetate + Dimethyl Sulfoxide

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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

1-Butanol, 3-methyl-, acetate

Name
1-Butanol, 3-methyl-, acetate
InChI
InChI=1S/C7H14O2/c1-6(2)4-5-9-7(3)8/h6H,4-5H2,1-3H3
InChI Key
MLFHJEHSLIIPHL-UHFFFAOYSA-N
Formula
C7H14O2
SMILES
CC(=O)OCCC(C)C
Mol. Weight (g/mol)
130.18
CAS
123-92-2

Dimethyl Sulfoxide

Name
Dimethyl Sulfoxide
InChI
InChI=1S/C2H6OS/c1-4(2)3/h1-2H3
InChI Key
IAZDPXIOMUYVGZ-UHFFFAOYSA-N
Formula
C2H6OS
SMILES
CS(C)=O
Mol. Weight (g/mol)
78.13
CAS
67-68-5
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Datasets

  1. Temperature, K x Mole fraction (2)

Temperature, K x Mole fraction [ref]

Operational condition: Pressure, kPa = 101.33 (Liquid)

Fixed Measured
Temperature, K - Liquid Mole fraction of 1-Butanol, 3-methyl- (1) - Liquid Mole fraction of 1-Butanol, 3-methyl-, acetate (2) - Liquid Mole fraction of 1-Butanol, 3-methyl-, acetate (2) - Gas Mole fraction of 1-Butanol, 3-methyl- (1) - Gas
433.24 0.3775 0.0109 0.0389 0.7279
431.48 0.1586 0.1847 0.5176 0.2213
430.68 0.1276 0.2132 0.5762 0.1612
430.21 0.1094 0.2283 0.6051 0.1357
430.13 0.0900 0.2450 0.6237 0.1062
428.65 0.0455 0.2840 0.6793 0.0525
428.35 0.0226 0.3048 0.6974 0.0256
433.06 0.3555 0.0303 0.1031 0.6633
432.93 0.3374 0.0437 0.1437 0.6129
433.04 0.3025 0.0708 0.2187 0.5320
433.10 0.2878 0.0769 0.2402 0.5101
433.59 0.2685 0.0882 0.2790 0.4663
432.92 0.2462 0.1078 0.3292 0.4148
433.07 0.2285 0.1207 0.3665 0.3738
432.08 0.1996 0.1493 0.4393 0.3012

Temperature, K x Mole fraction [ref]

Operational condition: Pressure, kPa = 101.33 (Liquid)

Fixed Measured
Temperature, K - Liquid Mole fraction of 1-Butanol, 3-methyl- (1) - Liquid Mole fraction of 1-Butanol, 3-methyl-, acetate (2) - Liquid Mole fraction of 1-Butanol, 3-methyl-, acetate (2) - Gas Mole fraction of 1-Butanol, 3-methyl- (1) - Gas
433.24 0.3775 0.0109 0.0389 0.7279
431.48 0.1586 0.1847 0.5176 0.2213
430.68 0.1276 0.2132 0.5762 0.1612
430.21 0.1094 0.2283 0.6051 0.1357
430.13 0.0900 0.2450 0.6237 0.1062
428.65 0.0455 0.2840 0.6793 0.0525
428.35 0.0226 0.3048 0.6974 0.0256
433.06 0.3555 0.0303 0.1031 0.6633
432.93 0.3374 0.0437 0.1437 0.6129
433.04 0.3025 0.0708 0.2187 0.5320
433.10 0.2878 0.0769 0.2402 0.5101
433.59 0.2685 0.0882 0.2790 0.4663
432.92 0.2462 0.1078 0.3292 0.4148
433.07 0.2285 0.1207 0.3665 0.3738
432.08 0.1996 0.1493 0.4393 0.3012

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