2,5-Furandione,3-phenyl- (36122-35-7)

The Phenylmaleic anhydride, with CAS registry number 36122-35-7, belongs to the following product categories: (1)Furans, Benzofurans & Dihydrobenzofurans; (2)Anhydride Monomers; (3)Monomers; (4)Polymer Science. Its systematic name and its IUPAC name are the same, which is 3-phenylfuran-2,5-dione. What's more, its EINECS is 252-881-8.

Physical properties of Phenylmaleic anhydride: (1)ACD/LogP: 1.84; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.84; (4)ACD/LogD (pH 7.4): 1.84; (5)ACD/BCF (pH 5.5): 14.62; (6)ACD/BCF (pH 7.4): 14.62; (7)ACD/KOC (pH 5.5): 237.45; (8)ACD/KOC (pH 7.4): 237.45; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 43.37 Å²; (13)Index of Refraction: 1.608; (14)Molar Refractivity: 44.35 cm³; (15)Molar Volume: 128.2 cm³; (16)Polarizability: 17.58×10^-24cm³; (17)Surface Tension: 54.8 dyne/cm; (18)Enthalpy of Vaporization: 58.53 kJ/mol; (19)Vapour Pressure: 7.94E-05 mmHg at 25°C.

Preparation: this chemical can be prepared by phenyl-succinic acid. This reaction will need reagent SeO₂ and solvent acetic anhydride. The reaction time is 12 hour(s). The yield is about 94.3%.

Uses of Phenylmaleic anhydride: it can be used to produce (Z)-3-morpholinocarbonyl-3-phenylpropenoic acid. This reaction will need solvent benzene. The yield is about 97%.

When you are using this chemical, please be cautious about it as the following:
The Phenylmaleic anhydride is harmful by inhalation, in contact with skin and if swallowed. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C2OC(=O)\C=C2\c1ccccc1
(2)InChI: InChI=1/C10H6O3/c11-9-6-8(10(12)13-9)7-4-2-1-3-5-7/h1-6H
(3)InChIKey: QZYCWJVSPFQUQC-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C10H6O3/c11-9-6-8(10(12)13-9)7-4-2-1-3-5-7/h1-6H
(5)Std. InChIKey: QZYCWJVSPFQUQC-UHFFFAOYSA-N