Chemical Properties of 2-Acetyl-1,4,5,6-tetrahydropyridine (CAS 25343-57-1)

2-Acetyl-1,4,5,6-tetrahydropyridine

InChI
InChI=1S/C7H11NO/c1-6(9)7-4-2-3-5-8-7/h4,8H,2-3,5H2,1H3
InChI Key
HRAOWRVFLSYJKN-UHFFFAOYSA-N
Formula
C7H11NO
SMILES
CC(=O)C1=CCCCN1
Molecular Weight1
125.17
CAS
25343-57-1
Other Names
  • Ethanone, 1-(1,4,5,6-tetrahydro-2-pyridinyl)-
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
ΔfusH° 16.67 kJ/mol Joback Calculated Property
logPoct/wat 0.843 Crippen Calculated Property
McVol 105.880 ml/mol McGowan Calculated Property
Inp [1017.00; 1062.00]   Show Hide
Inp 1061.00 NIST
Inp 1062.00 NIST
Inp 1017.00 NIST
Inp 1017.00 NIST
Inp 1018.00 NIST
Inp 1049.00 NIST
Inp 1017.00 NIST
Tboil 492.22 K Relay (1.0) Calculated Property
Tfus 343.67 K Relay (1.0) Calculated Property

Cheméo can also estimate 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [220.48; 290.61] J/mol×K [490.54; 717.53] Show Hide
Cp,gas 220.48 J/mol×K 490.54 Joback Calculated Property
Cp,gas 233.97 J/mol×K 528.37 Joback Calculated Property
Cp,gas 246.72 J/mol×K 566.20 Joback Calculated Property
Cp,gas 258.75 J/mol×K 604.03 Joback Calculated Property
Cp,gas 270.06 J/mol×K 641.86 Joback Calculated Property
Cp,gas 280.67 J/mol×K 679.70 Joback Calculated Property
Cp,gas 290.61 J/mol×K 717.53 Joback Calculated Property

Similar Compounds

2-Propionyl-1,4,5,6-tetrahydropyridine. 1,2,3,4,5,6-hexahydro-7H-cyclopenta[b]pyridin-7-one. 2,3,4,5,6,7-hexahydro-cyclopent[b]azepin-8(1H)-one. 2-acetyl-2-pyrroline. 7-methyl-2,3,4,5,6,7-hexahydrocyclopent[b]azepin-8(1H)-one. 1,2-bis-(1-Pyrrolidinyl)-1-buten-3-one. 6-methyl-1,2,3,4,5,6-hexahydro-7H-cyclopenta[b]pyridin-7-one. 6-ethyl-1,2,3,4,5,6-hexahydro-7H-cyclopenta[b]pyridin-7-one. 5-methyl-1,2,3,4,5,6-hexahydro-7H-cyclopenta[b]pyridin-7-one. 5-(1-hydroxyethylidene)-hexahydro-7H-cyclopenta[b]pyridin-7-one. 6,7-dimethyl-2,3,6,7-tetrahydro-cyclopent[b]azepin-8(1H)-one. Albine. Dehydroangustifoline. Fluspirilene. 13.alpha.-Tigloyloxymultiflorine.

Find more compounds similar to 2-Acetyl-1,4,5,6-tetrahydropyridine.

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.