Mixture of 1-Octanol + Simvastatin

1-Octanol

Name
1-Octanol
InChI
InChI=1S/C8H18O/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3
InChI Key
KBPLFHHGFOOTCA-UHFFFAOYSA-N
Formula
C8H18O
SMILES
CCCCCCCCO
Mol. Weight (g/mol)
130.23
CAS
111-87-5

Simvastatin

Name
Simvastatin
InChI
InChI=1S/C25H38O5/c1-6-25(4,5)24(28)30-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-19-13-18(26)14-22(27)29-19/h7-8,11,15-16,18-21,23,26H,6,9-10,12-14H2,1-5H3/t15-,16-,18+,19+,20-,21-,23-/m0/s1
InChI Key
RYMZZMVNJRMUDD-UHFFFAOYSA-N
Formula
C25H38O5
SMILES
CCC(C)(C)C(=O)OC1CC(C)C=C2C=CC(C)C(CCC3CC(O)CC(=O)O3)C21
Mol. Weight (g/mol)
418.57
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. Mole fraction (2)

Mole fraction of 1-Octanol (1) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of 1-Octanol (1) - Liquid
279.10 0.0208
282.20 0.0218
285.30 0.0226
288.50 0.0233
291.30 0.0251
296.10 0.0274
301.00 0.0299
305.80 0.0326
310.70 0.0360
315.50 0.0389

Mole fraction of 1-Octanol (1) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of 1-Octanol (1) - Liquid
279.10 0.0208
282.20 0.0218
285.30 0.0226
288.50 0.0233
291.30 0.0251
296.10 0.0274
301.00 0.0299
305.80 0.0326
310.70 0.0360
315.50 0.0389

Sources

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