Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

Ethyl 2-methyl-1H-imidazole-4-carboxylate

Related Products

Hot Products

Name

Ethyl 2-methyl-1H-imidazole-4-carboxylate

EINECS N/A
CAS No. 87326-25-8 Density 1.171
PSA 54.98000 LogP 0.89480
Solubility N/A Melting Point 136-137 °C
Formula C7H10N2O2 Boiling Point 339.7 °C at 760 mmHg
Molecular Weight 154.169 Flash Point 159.3 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 87326-25-8 (Ethyl 2-methyl-1H-imidazole-4-carboxylate) Hazard Symbols N/A
Synonyms

1H-Imidazole-4-carboxylicacid, 2-methyl-, ethyl ester (9CI);

Article Data 7

Ethyl 2-methyl-1H-imidazole-4-carboxylate Specification

The Ethyl 2-methyl-1H-imidazole-4-carboxylate, with the CAS registry number 87326-25-8, is also called 1H-imidazole-4-carboxylic acid, 2-methyl-, ethyl ester. It belongs to the product categories of Glycinescaffold and Heterocycle. And the molecular formula of the chemical is C7H10N2O2.

The characteristics of Ethyl 2-methyl-1H-imidazole-4-carboxylate are as followings: (1)ACD/LogP: 0.14; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.06; (4)ACD/LogD (pH 7.4): 0.14; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 23.39; (8)ACD/KOC (pH 7.4): 28.27; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 44.12 Å2; (13)Index of Refraction: 1.519; (14)Molar Refractivity: 40 cm3; (15)Molar Volume: 131.6 cm3; (16)Polarizability: 15.86×10-24cm3; (17)Surface Tension: 46.2 dyne/cm; (18)Density: 1.171 g/cm3; (19)Flash Point: 159.3 °C; (20)Enthalpy of Vaporization: 58.32 kJ/mol; (21)Boiling Point: 339.7 °C at 760 mmHg; (22)Vapour Pressure: 9.01E-05 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(OCC)c1cnc(n1)C
(2)InChI: InChI=1/C7H10N2O2/c1-3-11-7(10)6-4-8-5(2)9-6/h4H,3H2,1-2H3,(H,8,9)
(3)InChIKey: YCYQXJZURFKNLH-UHFFFAOYAZ

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 87326-25-8