The Ethyl 2,4-dimethyl-1H-pyrrole-3-carboxylate with CAS registry number of 2199-51-1 is also known as 1H-Pyrrole-3-carboxylic acid, 2,4-dimethyl-, ethyl ester. The IUPAC name is Ethyl 2,4-dimethyl-1H-pyrrole-3-carboxylate. It belongs to product categories of Pharmaceutial intermediates; Imidazoles, Pyrroles, Pyrazoles, Pyrrolidines; Intermediate of sunitinib malate. In addition, the formula is C₉H₁₃NO₂ and the molecular weight is 167.21.

Physical properties about Ethyl 2,4-dimethyl-1H-pyrrole-3-carboxylate are: (1)ACD/LogP: 2.60; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.6; (4)ACD/LogD (pH 7.4): 2.6; (5)ACD/BCF (pH 5.5): 55.64; (6)ACD/BCF (pH 7.4): 55.64; (7)ACD/KOC (pH 5.5): 617.94; (8)ACD/KOC (pH 7.4): 617.94; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 31.23Ų; (13)Index of Refraction: 1.516; (14)Molar Refractivity: 46.74 cm³; (15)Molar Volume: 154.7 cm³; (16)Polarizability: 18.52×10^-24cm³; (17)Surface Tension: 39 dyne/cm; (18)Density: 1.08 g/cm³; (19)Flash Point: 129.8 °C; (20)Enthalpy of Vaporization: 53.04 kJ/mol; (21)Boiling Point: 291 °C at 760 mmHg; (22)Vapour Pressure: 0.002 mmHg at 25 °C.

When you are using this chemical, please be cautious about it. As a chemical, it is irritating to eyes, respiratory system and skin. During using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1. Canonical SMILES: CCOC(=O)C1=C(NC=C1C)C
2. InChI: InChI=1S/C9H13NO2/c1-4-12-9(11)8-6(2)5-10-7(8)3/h5,10H,4H2,1-3H3
3. InChIKey: QWSFDUPEOPMXCV-UHFFFAOYSA-N