Mixture of cefuroxime acid + 2-Propanol

cefuroxime acid

Name
cefuroxime acid
InChI
InChI=1S/C16H16N4O8S/c1-26-19-9(8-3-2-4-27-8)12(21)18-10-13(22)20-11(15(23)24)7(5-28-16(17)25)6-29-14(10)20/h2-4,10,14H,5-6H2,1H3,(H2,17,25)(H,18,21)(H,23,24)/b19-9-/t10-,14-/m1/s1
InChI Key
JFPVXVDWJQMJEE-IZRZKJBUSA-N
Formula
C16H16N4O8S
SMILES
CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(N)=O)CSC12)c1ccco1
Mol. Weight (g/mol)
424.39

2-Propanol

Name
2-Propanol
InChI
InChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3
InChI Key
KFZMGEQAYNKOFK-UHFFFAOYSA-N
Formula
C3H8O
SMILES
CC(C)O
Mol. Weight (g/mol)
60.10
CAS
67-63-0
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

Mole fraction of cefuroxime acid (1) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of cefuroxime acid (1) - Liquid
278.50 0.0001
283.40 0.0001
288.30 0.0001
293.30 0.0001
298.30 0.0001
303.50 0.0001
308.30 0.0003
313.40 0.0003

Sources