Mixture of Acetonitrile + 1-Butanol + Pyrene

Excel

Acetonitrile

Name
Acetonitrile
InChI
InChI=1S/C2H3N/c1-2-3/h1H3
InChI Key
WEVYAHXRMPXWCK-UHFFFAOYSA-N
Formula
C2H3N
SMILES
CC#N
Mol. Weight (g/mol)
41.05
CAS
75-05-8

1-Butanol

Name
1-Butanol
InChI
InChI=1S/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3
InChI Key
LRHPLDYGYMQRHN-UHFFFAOYSA-N
Formula
C4H10O
SMILES
CCCCO
Mol. Weight (g/mol)
74.12
CAS
71-36-3

Pyrene

Name
Pyrene
InChI
InChI=1S/C16H10/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14/h1-10H
InChI Key
BBEAQIROQSPTKN-UHFFFAOYSA-N
Formula
C16H10
SMILES
c1cc2ccc3cccc4ccc(c1)c2c34
Mol. Weight (g/mol)
202.25
CAS
129-00-0
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Datasets

  1. Mole fraction (2)

Mole fraction of Pyrene (3) [ref]

Operational conditions:

Solvent: Mole fraction of Acetonitrile (1) - Liquid Mole fraction of Pyrene (3) - Liquid
0.0000 0.0062
0.1806 0.0103
0.3037 0.0122
0.5242 0.0136
0.6349 0.0128
0.7332 0.0118
0.8770 0.0089
0.9377 0.0075
1.0000 0.0061

Mole fraction of Pyrene (3) [ref]

Operational conditions:

Solvent: Mole fraction of Acetonitrile (1) - Liquid Mole fraction of Pyrene (3) - Liquid
0.0000 0.0062
0.1806 0.0103
0.3037 0.0122
0.5242 0.0136
0.6349 0.0128
0.7332 0.0118
0.8770 0.0089
0.9377 0.0075
1.0000 0.0061

Sources