4-(1,3-OXAZOL-5-YL)BENZOIC ACID

The Benzoic acid,4-(5-oxazolyl)-, with the CAS registry number 250161-45-6, is also known as 4-(1,3-Oxazol-5-yl)benzoic acid, 97%. It belongs to the product categories of Carboxylic Acids; Phenyls & Phenyl-Het; Carboxylic Acids; Phenyls & Phenyl-Het. This chemical's molecular formula is C₁₀H₇NO₃ and molecular weight is 189.17. Its systematic name is called 4-(1,3-oxazol-5-yl)benzoic acid.

Physical properties of Benzoic acid,4-(5-oxazolyl)-: (1)ACD/LogP: 1.65; (2)ACD/LogD (pH 5.5): -0.03; (3)ACD/LogD (pH 7.4): -1.36; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 3.92; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.587; (12)Molar Refractivity: 48.16 cm³; (13)Molar Volume: 143.2 cm³; (14)Surface Tension: 55.4 dyne/cm; (15)Density: 1.32 g/cm³; (16)Flash Point: 189.8 °C; (17)Enthalpy of Vaporization: 67.47 kJ/mol; (18)Boiling Point: 390.3 °C at 760 mmHg; (19)Vapour Pressure: 8.62E-07 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. 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. Whenever you will contact it, please wear suitable protective clothing and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c2ccc(c1ocnc1)cc2
(2)InChI: InChI=1/C10H7NO3/c12-10(13)8-3-1-7(2-4-8)9-5-11-6-14-9/h1-6H,(H,12,13)
(3)InChIKey: MCPBXFWYUHYSIZ-UHFFFAOYAX