Chemical Properties of 1H-Imidazole, 1,2-dimethyl- (CAS 1739-84-0)

InChI

InChI=1S/C5H8N2/c1-5-6-3-4-7(5)2/h3-4H,1-2H3

InChI Key

GIWQSPITLQVMSG-UHFFFAOYSA-N

Formula

C5H8N2

SMILES

Cc1nccn1C

Molecular Weight¹

96.13

CAS

1739-84-0

Other Names

• 1,2-dimethyl-1H-imidazole
• 1,2-dimethylimidazole
• N,2-Dimethylimidazole
• NSC 111174
• SN 25
• imidazole, 1,2-dimethyl-

• PAff : Proton affinity (kJ/mol).
• BasG : Gas basicity (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).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
PAff	984.70	kJ/mol	NIST
BasG	952.60	kJ/mol	NIST
IE	8.38	eV	NIST
logPoct/wat	0.729		Crippen Calculated Property
McVol	81.810	ml/mol	McGowan Calculated Property
Inp	[1006.00; 1006.00]
Inp	1006.00		NIST
Inp	1006.00		NIST
Inp	1006.00		NIST
I	1715.00		NIST
Tboil	[477.20; 479.20]	K
Tboil	477.20	K	NIST
Tboil	479.20	K	NIST
Tfus	311.50	K	Solubility of Imidazoles in Ethers

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, 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 1H-Imidazole, 1,2-dimethyl-.

Mixtures

• Di-n-propyl ether + 1H-Imidazole, 1,2-dimethyl-
• n-Butyl ether + 1H-Imidazole, 1,2-dimethyl-
• n-Amyl ether + 1H-Imidazole, 1,2-dimethyl-
• Propane, 2-methoxy-2-methyl- + 1H-Imidazole, 1,2-dimethyl-
• Butane, 2-methoxy-2-methyl- + 1H-Imidazole, 1,2-dimethyl-

Sources

• 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
• Solubility of Imidazoles in Ethers
• 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.
These property values are available through the Cheméo API. A free account gives you an access key.