Chemical Properties of Pyrazine, 2-methylthio-3-propyl

Pyrazine, 2-methylthio-3-propyl

InChI
InChI=1S/C8H12N2S/c1-3-4-7-8(11-2)10-6-5-9-7/h5-6H,3-4H2,1-2H3
InChI Key
BEHCKYZOZCUCEQ-UHFFFAOYSA-N
Formula
C8H12N2S
SMILES
CCCc1nccnc1SC
Molecular Weight1
168.27
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.

Physical Properties

Property Value Unit Source
logPoct/wat 2.151 Crippen Calculated Property
McVol 136.130 ml/mol McGowan Calculated Property
Inp [1320.00; 1320.00]   Show Hide
Inp 1320.00 NIST
Inp 1320.00 NIST
I [1764.00; 1764.00]   Show Hide
I 1764.00 NIST
I 1764.00 NIST
Tboil 513.75 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Pyrazine, 3-methylthio-2-pentyl. Pyrazine, 2-decyl-3-methylthio. Pyrazine, 2-(methylthio)-3-octyl. Pyrazine, 2-butyl-3-(ethylthio). 2-METHYLTHIO-3-ETHYLPYRAZINE. Pyrazine, 3-ethylthio-2-pentyl. Pyrazine, 2-(ethylthio)-3-octyl. Pyrazine, 2-decyl-3-ethylthio. Pyrazine, 2-ethyl-3-ethylthio. 2-Isopropyl-3-methylthiopyrazine. Pyrazine, 3-phenylthio-2-propyl. Pyrazine, 2-pentyl-3-phenylthio. 5-Isobutyl-3-methyl-2-(methylthio)pyrazine. Pyrazine, 2-octyl-3-phenylthio. Pyrazine, 2-(ethylthio)-3-methyl-5-(2-methylpropyl).

Find more compounds similar to Pyrazine, 2-methylthio-3-propyl.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.