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4-Phenoxyphthalic anhydride

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4-Phenoxyphthalic anhydride

EINECS 1533716-785-6
CAS No. 21345-01-7 Density 1.387 g/cm3
PSA 52.60000 LogP 2.78950
Solubility N/A Melting Point 112-113°C
Formula C14H8O4 Boiling Point 414.9 °C at 760 mmHg
Molecular Weight 240.215 Flash Point 187.8 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 21345-01-7 (5-Phenoxy-1,3-isobenzofurandione) Hazard Symbols N/A


Article Data 5

4-Phenoxyphthalic anhydride Specification

This chemical is called 4-Phenoxyphthalic anhydride, and it can also be named as 5-Phenoxy-1,3-isobenzofurandione. With the molecular formula of C14H8O4, its molecular weight is 240.21. The CAS registry number of this chemical is 21345-01-7.

Other characteristics of the chemical can be summarised as followings: (1)ACD/LogP: 3.59; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.59; (4)ACD/LogD (pH 7.4): 3.59; (5)ACD/BCF (pH 5.5): 316.01; (6)ACD/BCF (pH 7.4): 316.01; (7)ACD/KOC (pH 5.5): 2142.36; (8)ACD/KOC (pH 7.4): 2142.36; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 52.6 Å2; (13)Index of Refraction: 1.636; (14)Molar Refractivity: 62.12 cm3; (15)Molar Volume: 173.1 cm3; (16)Polarizability: 24.62×10-24cm3; (17)Surface Tension: 56.8 dyne/cm; (18)Density: 1.387 g/cm3; (19)Flash Point: 187.8 °C; (20)Enthalpy of Vaporization: 66.79 kJ/mol; (21)Boiling Point: 414.9 °C at 760 mmHg; (22)Vapour Pressure: 4.31E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: O=C1OC(=O)c2cc(ccc12)Oc3ccccc
2.InChI: InChI=1/C14H8O4/c15-13-11-7-6-10(8-12(11)14(16)18-13)17-9-4-2-1-3-5-9/h1-8H

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