Chemical Properties of Piperidine, 1,2-dimethyl- (CAS 671-36-3)

InChI

InChI=1S/C7H15N/c1-7-5-3-4-6-8(7)2/h7H,3-6H2,1-2H3

InChI Key

MWUISCCBFHLWLY-UHFFFAOYSA-N

Formula

C7H15N

SMILES

CC1CCCCN1C

Molecular Weight¹

113.20

CAS

671-36-3

Other Names

• 1,2-Dimethylpiperidine

• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔvapH°	40.45	kJ/mol	Relay (1.0) Calculated Property
IE	7.63 ± 0.05	eV	NIST
logPoct/wat	1.491		Crippen Calculated Property
McVol	108.610	ml/mol	McGowan Calculated Property
Inp	[834.00; 841.00]
Inp	841.00		NIST
Inp	834.00		NIST
Inp	841.00		NIST
I	[1000.00; 1000.00]
I	1000.00		NIST
I	1000.00		NIST
Tboil	401.00 ± 1.00	K	NIST

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, 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

Find more compounds similar to Piperidine, 1,2-dimethyl-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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.
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