The Benzene,1,1',1''-methylidynetris-, with CAS registry number 519-73-3, belongs to the following product categories: (1)Arenes; (2)Building Blocks; (3)Organic Building Blocks. It has the systematic name of 1,1',1''-methanetriyltribenzene. This chemical should be stored at the temperature of 2-8°C. The main use of this chemical is for organic synthesis and synthetic dyestuff.
Physical properties of Benzene,1,1',1''-methylidynetris-: (1)ACD/LogP: 5.69; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.69; (4)ACD/LogD (pH 7.4): 5.69; (5)ACD/BCF (pH 5.5): 12403.67; (6)ACD/BCF (pH 7.4): 12403.67; (7)ACD/KOC (pH 5.5): 29631.37; (8)ACD/KOC (pH 7.4): 29631.37; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.603; (14)Molar Refractivity: 79.96 cm3; (15)Molar Volume: 232.6 cm3; (16)Polarizability: 31.7×10-24cm3; (17)Surface Tension: 41.6 dyne/cm; (18)Enthalpy of Vaporization: 58.18 kJ/mol; (19)Vapour Pressure: 4.74E-05 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
The Trimesic acid irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. You should do not breathe dust and avoid contact with skin and eyes. 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: c1c(cccc1)C(c2ccccc2)c3ccccc3
(2)InChI: InChI=1/C19H16/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15,19H
(3)InChIKey: AAAQKTZKLRYKHR-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C19H16/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15,19H
(5)Std. InChIKey: AAAQKTZKLRYKHR-UHFFFAOYSA-N
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