2-ETHYLPYRROLE

The 1H-Pyrrole, 2-ethyl-, with the CAS registry number 1551-06-0, is also known as 2-Ethylpyrrole. It belongs to the product categories of Building Blocks; Heterocyclic Building Blocks; Pyrroles. This chemical's molecular formula is C₆H₉N and molecular weight is 95.14. What's more, its IUPAC name is 2-ethyl-1H-pyrrole. It should be sealed and stored in a cool and dry place. What's more, it should be protected from oxides. It should be ensured that the workshop is well ventilated or equipped with exhaust devices.

Physical properties of 1H-Pyrrole, 2-ethyl- are: (1)ACD/LogP: 1.74; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.74; (4)ACD/BCF (pH 5.5): 12.4; (5)ACD/KOC (pH 5.5): 211.03; (6)#H bond acceptors: 1; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 4.93 Å²; (10)Index of Refraction: 1.513; (11)Molar Refractivity: 30.23 cm³; (12)Molar Volume: 100.5 cm³; (13)Polarizability: 11.98×10^-24cm³; (14)Surface Tension: 34.3 dyne/cm; (15)Density: 0.945 g/cm³; (16)Flash Point: 62.2 °C; (17)Enthalpy of Vaporization: 38.41 kJ/mol; (18)Boiling Point: 164 °C at 760 mmHg; (19)Vapour Pressure: 2.63 mmHg at 25°C.

Preparation of 1H-Pyrrole, 2-ethyl-: this chemical can be prepared by 1-pyrrol-2-yl-ethanone at the temperature of 200 °C. This reaction will need reagents 95% hydrazine hydrate, KOH and solvent ethane-1,2-diol with the reaction time of 1.5 hours. The yield is about 65%.

Uses of 1H-Pyrrole, 2-ethyl-: it can be used to produce 4-hydroxyimino-hexanal oxime by heating. It will need reagents sodium bicarbonate, hydroxylamine hydrochloride and solvent 1,2-dimethoxy-ethane with the reaction time of 48 hours. The yield is about 46%.

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

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCC1=CC=CN1
(2)InChI: InChI=1S/C6H9N/c1-2-6-4-3-5-7-6/h3-5,7H,2H2,1H3
(3)InChIKey: XRPDDDRNQJNHLQ-UHFFFAOYSA-N