Chemical Properties of Isopropylhexedrine

Isopropylhexedrine

InChI
InChI=1S/C10H21N/c1-9(8-11-2)10-6-4-3-5-7-10/h9-11H,3-8H2,1-2H3
InChI Key
AGJJTKRYTPXPGM-UHFFFAOYSA-N
Formula
C10H21N
SMILES
CNCC(C)C1CCCCC1
Molecular Weight1
155.29
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
ω 0.3762 Relay (1.0) Calculated Property
ΔfH°gas -145.75 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 15.07 kJ/mol Joback Calculated Property
ΔvapH° 57.79 kJ/mol Relay (1.0) Calculated Property
IE 7.99 eV Relay (1.0) Calculated Property
logPoct/wat 2.422 Crippen Calculated Property
McVol 150.880 ml/mol McGowan Calculated Property
Pc 2624.46 kPa Joback Calculated Property
Inp 1140.00 NIST
Tboil 478.71 K Relay (1.0) Calculated Property
Tc 681.13 K Relay (1.0) Calculated Property
Tfus 259.04 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, 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 [355.48; 460.08] J/mol×K [497.48; 700.99] Show Hide
Cp,gas 355.48 J/mol×K 497.48 Joback Calculated Property
Cp,gas 375.40 J/mol×K 531.40 Joback Calculated Property
Cp,gas 394.29 J/mol×K 565.32 Joback Calculated Property
Cp,gas 412.17 J/mol×K 599.24 Joback Calculated Property
Cp,gas 429.08 J/mol×K 633.15 Joback Calculated Property
Cp,gas 445.04 J/mol×K 667.07 Joback Calculated Property
Cp,gas 460.08 J/mol×K 700.99 Joback Calculated Property

Similar Compounds

Isoquinoline, decahydro-. 1-Hexanamine, 2-ethyl-N-(2-ethylhexyl)-. 3-Azabicyclo[3.2.2]nonane. 3-Propyl-pyrrolidine. 3-Propyl-piperidine. 3-Ethyl-piperidine. Piperidine, 3,5-dimethyl-. Piperidine, 3-methyl-. Piperidin, 3e-methyl. 7-Methyl-1,5-diazacyclotetradecane. Isobutyramide, N-(2-ethylhexyl)-. 3-Ethyl-pyrrolidine. 4-Methyl-hexahydroazepine. 1H-Indole, octahydro-3-methyl-. 3-ethyl-octahydroindole.

Find more compounds similar to Isopropylhexedrine.

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.