4-N-BUTYLBENZAMIDE

The Benzamide, 4-butyl-, with the CAS registry number 107377-07-1, is also known as 4-N-Butylbenzamide. It belongs to the product category of Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts. This chemical's molecular formula is C₁₁H₁₅NO and molecular weight is 177.24. What's more, its systematic name is 4-butylbenzamide. It is stable at common pressure and temperature, and it should be sealed and stored in a cool and dry place. What's more, it should be protected from strong oxides.

Physical properties of Benzamide, 4-butyl- are: (1)ACD/LogP: 2.80; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.79; (4)ACD/BCF (pH 5.5): 78.33; (5)ACD/KOC (pH 5.5): 789.4; (6)#H bond acceptors: 2; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 4; (9)Polar Surface Area: 20.31 Å²; (10)Index of Refraction: 1.533; (11)Molar Refractivity: 53.99 cm³; (12)Molar Volume: 173.9 cm³; (13)Surface Tension: 40.1 dyne/cm; (14)Density: 1.018 g/cm³; (15)Flash Point: 141.2 °C; (16)Enthalpy of Vaporization: 55.06 kJ/mol; (17)Boiling Point: 309.9 °C at 760 mmHg; (18)Vapour Pressure: 0.000622 mmHg at 25°C.

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 gloves.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCCC1=CC=C(C=C1)C(=O)N
(2)InChI: InChI=1S/C11H15NO/c1-2-3-4-9-5-7-10(8-6-9)11(12)13/h5-8H,2-4H2,1H3,(H2,12,13)
(3)InChIKey: KFINRIKJBULSTD-UHFFFAOYSA-N