Mixture of 5-Hydroxymethylfurfural + 1-Propanol, 2-methyl- + Water

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5-Hydroxymethylfurfural

Name
5-Hydroxymethylfurfural
InChI
InChI=1S/C6H6O3/c7-3-5-1-2-6(4-8)9-5/h1-3,8H,4H2
InChI Key
NOEGNKMFWQHSLB-UHFFFAOYSA-N
Formula
C6H6O3
SMILES
O=Cc1ccc(CO)o1
Mol. Weight (g/mol)
126.11
CAS
67-47-0

1-Propanol, 2-methyl-

Name
1-Propanol, 2-methyl-
InChI
InChI=1S/C4H10O/c1-4(2)3-5/h4-5H,3H2,1-2H3
InChI Key
ZXEKIIBDNHEJCQ-UHFFFAOYSA-N
Formula
C4H10O
SMILES
CC(C)CO
Mol. Weight (g/mol)
74.12
CAS
78-83-1

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 (2)

Temperature, K x Mass fraction [ref]

Operational condition: Pressure, kPa = 100 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 2 Mass fraction of 1-Propanol, 2-methyl- (2) - Liquid mixture 1 Mass fraction of 5-Hydroxymethylfurfural (1) - Liquid mixture 1 Mass fraction of 1-Propanol, 2-methyl- (2) - Liquid mixture 2 Mass fraction of 5-Hydroxymethylfurfural (1) - Liquid mixture 2
313.15 0.5620 0.1800 0.1290 0.1030
323.15 0.7820 0.0380 0.0800 0.0130
333.15 0.5380 0.1810 0.1130 0.1070
333.15 0.6030 0.1490 0.0990 0.0840
333.15 0.6310 0.1290 0.0880 0.0620
333.15 0.6830 0.0830 0.0830 0.0360
333.15 0.7330 0.0370 0.0680 0.0140
313.15 0.6150 0.1540 0.1010 0.0860
313.15 0.6960 0.1140 0.0870 0.0600
313.15 0.7460 0.0810 0.0830 0.0390
313.15 0.8010 0.0380 0.0830 0.0150
323.15 0.5590 0.1720 0.1210 0.1060
323.15 0.6230 0.1460 0.1070 0.0820
323.15 0.6770 0.1130 0.0960 0.0580
323.15 0.7250 0.0740 0.0870 0.0350

Temperature, K x Mass fraction [ref]

Operational condition: Pressure, kPa = 100 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 2 Mass fraction of 1-Propanol, 2-methyl- (2) - Liquid mixture 1 Mass fraction of 5-Hydroxymethylfurfural (1) - Liquid mixture 1 Mass fraction of 1-Propanol, 2-methyl- (2) - Liquid mixture 2 Mass fraction of 5-Hydroxymethylfurfural (1) - Liquid mixture 2
313.15 0.5620 0.1800 0.1290 0.1030
323.15 0.7820 0.0380 0.0800 0.0130
333.15 0.5380 0.1810 0.1130 0.1070
333.15 0.6030 0.1490 0.0990 0.0840
333.15 0.6310 0.1290 0.0880 0.0620
333.15 0.6830 0.0830 0.0830 0.0360
333.15 0.7330 0.0370 0.0680 0.0140
313.15 0.6150 0.1540 0.1010 0.0860
313.15 0.6960 0.1140 0.0870 0.0600
313.15 0.7460 0.0810 0.0830 0.0390
313.15 0.8010 0.0380 0.0830 0.0150
323.15 0.5590 0.1720 0.1210 0.1060
323.15 0.6230 0.1460 0.1070 0.0820
323.15 0.6770 0.1130 0.0960 0.0580
323.15 0.7250 0.0740 0.0870 0.0350

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