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17289-20-2

Basic Information
CAS No.: 17289-20-2
Name: Methyl 1-methylimidazole-5-carboxylate
Article Data: 3
Molecular Structure:
Molecular Structure of 17289-20-2 (Methyl 1-methylimidazole-5-carboxylate)
Formula: C6H8N2O2
Molecular Weight: 140.142
Synonyms: Imidazole-5-carboxylicacid, 1-methyl-, methyl ester (6CI,7CI,8CI);3-Methyl-3H-imidazole-4-carboxylicacid methyl ester;5-Carbomethoxy-1-methylimidazole;Methyl1-methyl-1H-imidazole-5-carboxylate;Methyl 1-methylimidazole-5-carboxylate;methyl 3-methylimidazole-4-carboxylate;
EINECS: 1806241-263-5
Density: 1.188 g/cm3
Melting Point: 48-50°C
Boiling Point: 284.625 °C at 760 mmHg
Flash Point: 125.937 °C
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-37/39
PSA: 44.12000
LogP: 0.20670
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    Best price/ Methyl 1-methyl-1H-imidazole-5-carboxylate CAS NO.17289-20-2

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  • Methyl 1-methyl-1H-imidazole-5-carboxylate

  • Casno:

    17289-20-2

    Methyl 1-methyl-1H-imidazole-5-carboxylate

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  • 17289-20-2

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    17289-20-2

    17289-20-2

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  • Methyl 1-MethyliMidazole-5-carboxylate

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    17289-20-2

    Methyl 1-MethyliMidazole-5-carboxylate

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  • methyl 1-methyl-1H-imidazole-5-carboxylate

  • Casno:

    17289-20-2

    methyl 1-methyl-1H-imidazole-5-carboxylate

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Specification

The Methyl 1-methylimidazole-5-carboxylate, with the CAS registry number 17289-20-2, has the systematic name of methyl 1-methyl-1H-imidazole-5-carboxylate. It belongs to the following product categories: Blocks; Carboxes; Imidazoles. And the molecular formula of the chemical is C6H8N2O2.

The characteristics of Methyl 1-methylimidazole-5-carboxylate are as followings: (1)ACD/LogP: -0.23; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.26; (4)ACD/LogD (pH 7.4): -0.23; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 16.77; (8)ACD/KOC (pH 7.4): 17.81; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 44.12 Å2; (13)Index of Refraction: 1.531; (14)Molar Refractivity: 36.52 cm3; (15)Molar Volume: 117.9 cm3; (16)Polarizability: 14.47×10-24cm3; (17)Surface Tension: 39 dyne/cm; (18)Density: 1.18 g/cm3; (19)Flash Point: 125.9 °C; (20)Enthalpy of Vaporization: 52.36 kJ/mol; (21)Boiling Point: 284.6 °C at 760 mmHg; (22)Vapour Pressure: 0.00294 mmHg at 25°C.

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(OC)c1cncn1C
(2)InChI: InChI=1/C6H8N2O2/c1-8-4-7-3-5(8)6(9)10-2/h3-4H,1-2H3
(3)InChIKey: AKDPLDCXQNEMCL-UHFFFAOYAG