3-(4-METHOXYPHENYL)-1-PROPANOL

The Benzenepropanol,4-methoxy-, with the CAS registry number 5406-18-8, is also known as 4-Methoxybenzenepropanol and p-Methoxyphenylpropanol. It belongs to the product categories of Alcohols; C9 to C30; Oxygen Compounds. Its EINECS registry number is 226-463-0. This chemical's molecular formula is C₁₀H₁₄O₂ and molecular weight is 166.217. What's more, both its IUPAC name and systematic name are the same which is called 3-(4-Methoxyphenyl)propan-1-ol.

Physical properties about this chemical are: (1)ACD/LogP: 1.79; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.79; (4)ACD/LogD (pH 7.4): 1.79; (5)ACD/BCF (pH 5.5): 13.61; (6)ACD/BCF (pH 7.4): 13.61; (7)ACD/KOC (pH 5.5): 225.5; (8)ACD/KOC (pH 7.4): 225.5; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 18.46 Å²; (13)Index of Refraction: 1.519; (14)Molar Refractivity: 48.64 cm³; (15)Molar Volume: 160.2 cm³; (16)Surface Tension: 37.6 dyne/cm; (17)Density: 1.037 g/cm³; (18)Flash Point: 122.3 °C; (19)Enthalpy of Vaporization: 55.22 kJ/mol; (20)Boiling Point: 283.9 °C at 760 mmHg; (21)Vapour Pressure: 0.00145 mmHg at 25 °C; (22)Melting Point: 26 °C.

Preparation of Benzenepropanol,4-methoxy-: this chemical can be prepared by 3-(4-Methoxy-phenyl)-propionic acid.

This reaction needs reagent Lithium aluminum hydride and solvent Diethyl ether at temperature of 25 °C. The reaction time is 5 hours. The yield is 97.5%.

Uses of Benzenepropanol,4-methoxy-: it is used to produce other chemicals. For example, it is used to produce 4-(3-Bromo-propyl)-anisole.



The reaction occurs with reagents CBr₄, Ph₃P and solvent CH₂Cl₂ at temperature of 0 °C. The reaction time is 24 hours.

You can still convert the following datas into molecular structure:
(1) SMILES: O(c1ccc(cc1)CCCO)C
(2) InChI: InChI=1/C10H14O2/c1-12-10-6-4-9(5-7-10)3-2-8-11/h4-7,11H,2-3,8H2,1H3
(3) InChIKey: NIIDHUCLROLCBU-UHFFFAOYAI