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7195-47-3

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Basic Information
CAS No.: 7195-47-3
Name: tetrakis(oxiranylmethyl) benzene-1,2,4,5-tetracarboxylate
Molecular Structure:
Molecular Structure of 7195-47-3 (tetrakis(oxiranylmethyl) benzene-1,2,4,5-tetracarboxylate)
Formula: C22H22O12
Molecular Weight: 478.409
Synonyms: 1,2,4,5-Benzenetetracarboxylicacid, tetrakis(2,3-epoxypropyl) ester (7CI,8CI);1,2,4,5-Benzenetetracarboxylicacid, tetrakis(oxiranylmethyl) ester (9CI);1-Propanol, 2,3-epoxy-,1,2,4,5-benzenetetracarboxylate (4:1) (8CI);Tetraglycidyl pyromellitate;
EINECS: 230-567-1
Density: 1.484 g/cm3
Boiling Point: 604.5 °C at 760 mmHg
Flash Point: 261.9 °C
PSA: 155.32000
LogP: -0.09100
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    1,2,4,5-Benzenetetracarboxylicacid, 1,2,4,5-tetrakis(2-oxiranylmethyl) ester

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  • 1,2,4,5-Benzenetetracarboxylicacid, 1,2,4,5-tetrakis(2-oxiranylmethyl) ester

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    1,2,4,5-Benzenetetracarboxylicacid, 1,2,4,5-tetrakis(2-oxiranylmethyl) ester

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Specification

This chemical is called Tetrakis(oxiranylmethyl) benzene-1,2,4,5-tetracarboxylate, and it can also be named as 1,2,4,5-benzenetetracarboxylic acid, tetrakis(oxiranylmethyl) ester. With the molecular formula of C22H22O12, its molecular weight is 478.40. The CAS registry number of this chemical is 7195-47-3.

Other characteristics of the Tetrakis(oxiranylmethyl) benzene-1,2,4,5-tetracarboxylate can be summarised as followings: (1)ACD/LogP: 2.40; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 2.4; (4)ACD/LogD (pH 7.4): 2.4; (5)ACD/BCF (pH 5.5): 39.26; (6)ACD/BCF (pH 7.4): 39.26; (7)ACD/KOC (pH 5.5): 481.49; (8)ACD/KOC (pH 7.4): 481.49; (9)#H bond acceptors: 12; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 16; (12)Polar Surface Area: 155.32 Å2; (13)Index of Refraction: 1.589; (14)Molar Refractivity: 108.7 cm3; (15)Molar Volume: 322.2 cm3; (16)Polarizability: 43.09×10-24cm3; (17)Surface Tension: 70.9 dyne/cm; (18)Density: 1.484 g/cm3; (19)Flash Point: 261.9 °C; (20)Enthalpy of Vaporization: 89.89 kJ/mol; (21)Boiling Point: 604.5 °C at 760 mmHg; (22)Vapour Pressure: 1.46E-14 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: O=C(OCC1OC1)c5c(C(=O)OCC2OC2)cc(C(=O)OCC3OC3)c(C(=O)OCC4OC4)c5
2.InChI: InChI=1/C22H22O12/c23-19(31-7-11-3-27-11)15-1-16(20(24)32-8-12-4-28-12)18(22(26)34-10-14-6-30-14)2-17(15)21(25)33-9-13-5-29-13/h1-2,11-14H,3-10H2
3.InChIKey: IJTDINJRSNQFSI-UHFFFAOYAF