The Benzoic acid,2-propoxy-, with the CAS registry number 2100-31-4, is also known as 2-n-Propoxybenzoic acid. It belongs to the product categories of Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts; Organic acids; Acids & Esters; Anisoles, Alkyloxy Compounds & Phenylacetates. This chemical's molecular formula is C₁₀H₁₂O₃ and molecular weight is 180.2. Its IUPAC name is called 2-propoxybenzoate. This chemical can be used for pharmaceutical intermediates and used in organic synthesis. What's more, you should keep the storage areas to avoid contact with oxidants, the container sealed, stored inside a sealed storage, a cool, dry place.

Physical properties of Benzoic acid,2-propoxy-: (1)ACD/LogP: 2.56; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.55; (4)ACD/LogD (pH 7.4): -0.53; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 5.82; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Index of Refraction: 1.53; (13)Molar Refractivity: 49.12 cm³; (14)Molar Volume: 158.9 cm³; (15)Surface Tension: 42.3 dyne/cm; (16)Density: 1.133 g/cm³; (17)Flash Point: 120 °C; (18)Enthalpy of Vaporization: 57.73 kJ/mol; (19)Boiling Point: 306.3 °C at 760 mmHg; (20)Vapour Pressure: 0.00034 mmHg at 25°C.

Uses of Benzoic acid,2-propoxy-: it can be used to produce 2-(2-propoxy-phenyl)-3H-imidazo[4,5-b]pyridine by heating. This reaction will need reagent POCl₃ with reaction time of 7 hours. The yield is about 69%.

When you are using this chemical, please be cautious about it as the following:
This chemical 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.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCOC1=CC=CC=C1C(=O)[O-]
(2)InChI: InChI=1S/C10H12O3/c1-2-7-13-9-6-4-3-5-8(9)10(11)12/h3-6H,2,7H2,1H3,(H,11,12)/p-1
(3)InChIKey: OXOWWPXTTOCKKU-UHFFFAOYSA-M