Mixture of Indomethacin + Methyl Alcohol + Niacinamide

Excel

Indomethacin

Name
Indomethacin
InChI
InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)
InChI Key
CGIGDMFJXJATDK-UHFFFAOYSA-N
Formula
C19H16ClNO4
SMILES
COc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c1ccc(Cl)cc1
Mol. Weight (g/mol)
357.79
CAS
53-86-1

Methyl Alcohol

Name
Methyl Alcohol
InChI
InChI=1S/CH4O/c1-2/h2H,1H3
InChI Key
OKKJLVBELUTLKV-UHFFFAOYSA-N
Formula
CH4O
SMILES
CO
Mol. Weight (g/mol)
32.04
CAS
67-56-1

Niacinamide

Name
Niacinamide
InChI
InChI=1S/C6H6N2O/c7-6(9)5-2-1-3-8-4-5/h1-4H,(H2,7,9)
InChI Key
DFPAKSUCGFBDDF-UHFFFAOYSA-N
Formula
C6H6N2O
SMILES
N=C(O)c1cccnc1
Mol. Weight (g/mol)
122.12
CAS
98-92-0
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Datasets

  1. Mass fraction (20)

Mass fraction of Niacinamide (3) [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid)

Fixed Measured
Temperature, K - Liquid Mass fraction of Indomethacin (1) - Liquid Mass fraction of Niacinamide (3) - Liquid
298.15 0.0000 0.2556
313.15 0.0000 0.3640
298.15 0.0248 0.2501
313.15 0.0537 0.3560

Mass fraction of Niacinamide (3) [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid)

Fixed Measured
Temperature, K - Liquid Mass fraction of Indomethacin (1) - Liquid Mass fraction of Niacinamide (3) - Liquid
298.15 0.0248 0.2501
298.15 0.0243 0.2471
298.15 0.0256 0.1716
298.15 0.0263 0.1496
298.15 0.0290 0.1105
298.15 0.0318 0.0880
298.15 0.0317 0.0875
313.15 0.0537 0.3560
313.15 0.0545 0.3491
313.15 0.0597 0.2748
313.15 0.0630 0.2498
313.15 0.0696 0.1996
313.15 0.0722 0.1879
313.15 0.0796 0.1680
313.15 0.0891 0.1367
313.15 0.0955 0.1268
313.15 0.0984 0.1237

Mass fraction of Niacinamide (3) [ref]

Operational conditions:

Mass fraction of Indomethacin (1) - Liquid Mass fraction of Niacinamide (3) - Liquid
0.0317 0.0875
0.0287 0.0772
0.0272 0.0525
0.0234 0.0320
0.0227 0.0183
0.0218 0.0113
0.0203 0.0074
0.0201 0.0047
0.0203 0.0031
0.0196 0.0018
0.0188 0.0013
0.0201 0.0000

Mass fraction of Niacinamide (3) [ref]

Operational conditions:

Mass fraction of Indomethacin (1) - Liquid Mass fraction of Niacinamide (3) - Liquid
0.0984 0.1237
0.0620 0.0540
0.0485 0.0267
0.0449 0.0000

Mass fraction of Niacinamide (3) [ref]

Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Mass fraction of Niacinamide (3) - Liquid
298.15 101.30 0.0875

Mass fraction of Indomethacin (1) [ref]

Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Mass fraction of Indomethacin (1) - Liquid
298.15 101.30 0.0317

Mass fraction of Niacinamide (3) [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid)

Temperature, K - Liquid Mass fraction of Niacinamide (3) - Liquid
298.15 0.2501
313.15 0.3560

Mass fraction of Indomethacin (1) [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid)

Temperature, K - Liquid Mass fraction of Indomethacin (1) - Liquid
298.15 0.0248
313.15 0.0537

Mass fraction of Niacinamide (3) [ref]

Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Mass fraction of Niacinamide (3) - Liquid
298.15 101.30 0.1237

Mass fraction of Indomethacin (1) [ref]

Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Mass fraction of Indomethacin (1) - Liquid
298.15 101.30 0.0984

Mass fraction of Niacinamide (3) [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid)

Fixed Measured
Temperature, K - Liquid Mass fraction of Indomethacin (1) - Liquid Mass fraction of Niacinamide (3) - Liquid
298.15 0.0000 0.2556
313.15 0.0000 0.3640
298.15 0.0248 0.2501
313.15 0.0537 0.3560

Mass fraction of Niacinamide (3) [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid)

Fixed Measured
Temperature, K - Liquid Mass fraction of Indomethacin (1) - Liquid Mass fraction of Niacinamide (3) - Liquid
298.15 0.0248 0.2501
298.15 0.0243 0.2471
298.15 0.0256 0.1716
298.15 0.0263 0.1496
298.15 0.0290 0.1105
298.15 0.0318 0.0880
298.15 0.0317 0.0875
313.15 0.0537 0.3560
313.15 0.0545 0.3491
313.15 0.0597 0.2748
313.15 0.0630 0.2498
313.15 0.0696 0.1996
313.15 0.0722 0.1879
313.15 0.0796 0.1680
313.15 0.0891 0.1367
313.15 0.0955 0.1268
313.15 0.0984 0.1237

Mass fraction of Niacinamide (3) [ref]

Operational conditions:

Mass fraction of Indomethacin (1) - Liquid Mass fraction of Niacinamide (3) - Liquid
0.0317 0.0875
0.0287 0.0772
0.0272 0.0525
0.0234 0.0320
0.0227 0.0183
0.0218 0.0113
0.0203 0.0074
0.0201 0.0047
0.0203 0.0031
0.0196 0.0018
0.0188 0.0013
0.0201 0.0000

Mass fraction of Niacinamide (3) [ref]

Operational conditions:

Mass fraction of Indomethacin (1) - Liquid Mass fraction of Niacinamide (3) - Liquid
0.0984 0.1237
0.0620 0.0540
0.0485 0.0267
0.0449 0.0000

Mass fraction of Niacinamide (3) [ref]

Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Mass fraction of Niacinamide (3) - Liquid
298.15 101.30 0.0875

Mass fraction of Indomethacin (1) [ref]

Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Mass fraction of Indomethacin (1) - Liquid
298.15 101.30 0.0317

Mass fraction of Niacinamide (3) [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid)

Temperature, K - Liquid Mass fraction of Niacinamide (3) - Liquid
298.15 0.2501
313.15 0.3560

Mass fraction of Indomethacin (1) [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid)

Temperature, K - Liquid Mass fraction of Indomethacin (1) - Liquid
298.15 0.0248
313.15 0.0537

Mass fraction of Niacinamide (3) [ref]

Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Mass fraction of Niacinamide (3) - Liquid
298.15 101.30 0.1237

Mass fraction of Indomethacin (1) [ref]

Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Mass fraction of Indomethacin (1) - Liquid
298.15 101.30 0.0984

Sources