Mixture of Pentoxifylline + D-Alanine + Water

Pentoxifylline

Name
Pentoxifylline
InChI
InChI=1S/C13H18N4O3/c1-9(18)6-4-5-7-17-12(19)10-11(14-8-15(10)2)16(3)13(17)20/h8H,4-7H2,1-3H3
InChI Key
BYPFEZZEUUWMEJ-UHFFFAOYSA-N
Formula
C13H18N4O3
SMILES
CC(=O)CCCCn1c(=O)c2c(ncn2C)n(C)c1=O
Mol. Weight (g/mol)
278.31
CAS
6493-05-6

D-Alanine

Name
D-Alanine
InChI
InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1
InChI Key
QNAYBMKLOCPYGJ-REOHCLBHSA-N
Formula
C3H7NO2
SMILES
C[C@@H](N)C(=O)O
Mol. Weight (g/mol)
89.09

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
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Datasets

  1. ρl - Mass density, kg/m3 (2)

Mass density, kg/m3 [ref]

Operational conditions:

Fixed Measured
Temperature, K - Liquid Molality, mol/kg of D-Alanine (2) - Liquid Mass density, kg/m3 - Liquid
293.15 0.0000 1003.813
293.15 0.0631 1005.625
293.15 0.1050 1006.818
293.15 0.1515 1008.136
293.15 0.2013 1009.526
293.15 0.2351 1010.465
293.15 0.3023 1012.326
298.15 0.0000 1002.551
298.15 0.0631 1004.347
298.15 0.1050 1005.529
298.15 0.1515 1006.834
298.15 0.2013 1008.214
298.15 0.2351 1009.145
298.15 0.3023 1010.993
303.15 0.0000 1001.058
303.15 0.0631 1002.839
303.15 0.1050 1004.012
303.15 0.1515 1005.308
303.15 0.2013 1006.68
303.15 0.2351 1007.607
303.15 0.3023 1009.438
308.15 0.0000 999.356
308.15 0.0631 1001.127
308.15 0.1050 1002.293
308.15 0.1515 1003.582
308.15 0.2013 1004.949
308.15 0.2351 1005.871
308.15 0.3023 1007.691

Mass density, kg/m3 [ref]

Operational conditions:

Fixed Measured
Temperature, K - Liquid Molality, mol/kg of D-Alanine (2) - Liquid Mass density, kg/m3 - Liquid
293.15 0.0000 1003.813
293.15 0.0631 1005.625
293.15 0.1050 1006.818
293.15 0.1515 1008.136
293.15 0.2013 1009.526
293.15 0.2351 1010.465
293.15 0.3023 1012.326
298.15 0.0000 1002.551
298.15 0.0631 1004.347
298.15 0.1050 1005.529
298.15 0.1515 1006.834
298.15 0.2013 1008.214
298.15 0.2351 1009.145
298.15 0.3023 1010.993
303.15 0.0000 1001.058
303.15 0.0631 1002.839
303.15 0.1050 1004.012
303.15 0.1515 1005.308
303.15 0.2013 1006.68
303.15 0.2351 1007.607
303.15 0.3023 1009.438
308.15 0.0000 999.356
308.15 0.0631 1001.127
308.15 0.1050 1002.293
308.15 0.1515 1003.582
308.15 0.2013 1004.949
308.15 0.2351 1005.871
308.15 0.3023 1007.691

Sources

Note: These property values are available through the Cheméo API. A free account gives you an access key.