Mixture of Heptane + Triclosan

Excel

Heptane

Name
Heptane
InChI
InChI=1S/C7H16/c1-3-5-7-6-4-2/h3-7H2,1-2H3
InChI Key
IMNFDUFMRHMDMM-UHFFFAOYSA-N
Formula
C7H16
SMILES
CCCCCCC
Mol. Weight (g/mol)
100.20
CAS
142-82-5

Triclosan

Name
Triclosan
InChI
InChI=1S/C12H7Cl3O2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H
InChI Key
XEFQLINVKFYRCS-UHFFFAOYSA-N
Formula
C12H7Cl3O2
SMILES
Oc1cc(Cl)ccc1Oc1ccc(Cl)cc1Cl
Mol. Weight (g/mol)
289.54
CAS
3380-34-5
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Datasets

  1. Mole fraction (2)

Mole fraction of Triclosan (2) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of Triclosan (2) - Liquid
293.15 0.0156
298.15 0.0286
303.15 0.0421
308.15 0.0605
313.15 0.0806

Mole fraction of Triclosan (2) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of Triclosan (2) - Liquid
293.15 0.0156
298.15 0.0286
303.15 0.0421
308.15 0.0605
313.15 0.0806

Sources