The Phosphoric acid,tris(3-methylphenyl) ester, with CAS registry number 563-04-2, has the systematic name of tris(3-methylphenyl) phosphate. Besides this, it is also called Tri-m-tolyl phosphate. This chemical is a kind of clear very slightly yellow to pink liquid. And the chemical formula of this chemical is C₂₁H₂₁O₄P. What's more, its EINECS is 209-241-8.

Physical properties of Phosphoric acid,tris(3-methylphenyl) ester: (1)ACD/LogP: 5.48; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.48; (4)ACD/LogD (pH 7.4): 5.48; (5)ACD/BCF (pH 5.5): 8564.12; (6)ACD/BCF (pH 7.4): 8564.12; (7)ACD/KOC (pH 5.5): 22730.27; (8)ACD/KOC (pH 7.4): 22730.27; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 54.57 Å²; (13)Index of Refraction: 1.58; (14)Molar Refractivity: 102.14 cm³; (15)Molar Volume: 306.6 cm³; (16)Polarizability: 40.49×10^-24cm³; (17)Surface Tension: 44.7 dyne/cm; (18)Density: 1.201 g/cm³; (19)Flash Point: 234.3 °C; (20)Enthalpy of Vaporization: 67.21 kJ/mol; (21)Boiling Point: 441.7 °C at 760 mmHg; (22)Vapour Pressure: 1.38E-07 mmHg at 25°C.

Preparation: this chemical can be prepared by 3-methyl-phenol. This reaction will need reagents POCl₃, aq. NaOH. The reaction time is 2.5 hour(s). The yield is about 87%.

When you are using this chemical, please be cautious about it as the following:
The Phosphoric acid,tris(3-methylphenyl) ester is harmful in contact with skin and if swallowed. After contact with skin, wash immediately with plenty of soap-suds. And it is toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment, so avoid release it to the environment. Refer to special instructions / safety data sheets.

You can still convert the following datas into molecular structure:
(1)SMILES: O=P(Oc1cc(ccc1)C)(Oc2cc(ccc2)C)Oc3cc(ccc3)C
(2)InChI: InChI=1/C21H21O4P/c1-16-7-4-10-19(13-16)23-26(22,24-20-11-5-8-17(2)14-20)25-21-12-6-9-18(3)15-21/h4-15H,1-3H3
(3)InChIKey: RMLPZKRPSQVRAB-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C21H21O4P/c1-16-7-4-10-19(13-16)23-26(22,24-20-11-5-8-17(2)14-20)25-21-12-6-9-18(3)15-21/h4-15H,1-3H3
(5)Std. InChIKey: RMLPZKRPSQVRAB-UHFFFAOYSA-N