4-N-PENTYLOXYBENZOYL CHLORIDE

The Benzoyl chloride,4-(pentyloxy)-, with the CAS registry number 36823-84-4, is also known as p-Pentoxybenzoyl chloride. Its EINECS registry number is 253-230-0. This chemical's molecular formula is C₁₂H₁₅ClO₂ and molecular weight is 226.7. What's more, its IUPAC name is 4-Pentoxybenzoyl chloride. Besides, it is clear colorless to light yellow liquid.

Physical properties about Benzoyl chloride,4-(pentyloxy)- are: (1)ACD/LogP: 4.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.5; (4)ACD/LogD (pH 7.4): 4.5; (5)ACD/BCF (pH 5.5): 1552.2; (6)ACD/BCF (pH 7.4): 1552.2; (7)ACD/KOC (pH 5.5): 6693.89; (8)ACD/KOC (pH 7.4): 6693.89; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.511; (14)Molar Refractivity: 61.7 cm³; (15)Molar Volume: 205.8 cm³; (16)Polarizability: 24.46×10^-24cm³; (17)Surface Tension: 36.7 dyne/cm; (18)Density: 1.101 g/cm³; (19)Flash Point: 120.5 °C; (20)Enthalpy of Vaporization: 56.65 kJ/mol; (21)Boiling Point: 324.5 °C at 760 mmHg; (22)Vapour Pressure: 0.000245 mmHg at 25 °C.

Use of Benzoyl chloride,4-(pentyloxy)-: it is used to produce other chemicals. For example, it is used to produce N-Benzothiazol-2-yl-4-pentyloxy-benzamide. The reaction occurs with reagent Pyridine and other condition of heating for 12 hours. The yield is 71 %.

When you are using this chemical, please be cautious about it as the following:
As a chemical, it may destroy living tissue on contact and irritate to eyes and respiratory system. In addition, this chemical may cause burns. 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. Besides, in case of accident or if you feel unwell, you should seek medical advice immediately (show the label where possible). In addition, it must be stored in airtight containers and placed in a dry, ventilated place.

You can still convert the following datas into molecular structure:
(1) SMILES: ClC(=O)c1ccc(OCCCCC)cc1
(2) InChI: InChI=1/C12H15ClO2/c1-2-3-4-9-15-11-7-5-10(6-8-11)12(13)14/h5-8H,2-4,9H2,1H3
(3) InChIKey: IBQDPNHVFRFCFK-UHFFFAOYAL