Mixture of Acetonitrile + 1-Propanol, 2-methyl- + Pyrene

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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-Propanol, 2-methyl-

Name
1-Propanol, 2-methyl-
InChI
InChI=1S/C4H10O/c1-4(2)3-5/h4-5H,3H2,1-2H3
InChI Key
ZXEKIIBDNHEJCQ-UHFFFAOYSA-N
Formula
C4H10O
SMILES
CC(C)CO
Mol. Weight (g/mol)
74.12
CAS
78-83-1

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 0.0033
0.1714 0.0064
0.3074 0.0087
0.5382 0.0107
0.6341 0.0106
0.7241 0.0099
0.8686 0.0080
0.9331 0.0070
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 0.0033
0.1714 0.0064
0.3074 0.0087
0.5382 0.0107
0.6341 0.0106
0.7241 0.0099
0.8686 0.0080
0.9331 0.0070
1.0000 0.0061

Sources