CAS No.7511-49-1,1,3,5-Tris(4-bromophenyl)benzene Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	7511-49-1
Name:	1,3,5-Tris(4-bromophenyl)benzene
Article Data:	3

Formula:	C₂₄H₁₅Br₃
Molecular Weight:	543.095
Synonyms:	Benzene,1,3,5-tris(p-bromophenyl)- (6CI,7CI);1,3,5-Tri(p-bromophenyl)benzene;1,3,5-Tris(4-bromophenyl)benzene;1,3,5-Tris(p-bromophenyl)benzene;NSC 30660;
EINECS:	628-099-1
Density:	1.627 g/cm³
Melting Point:	261-265 ºC
Boiling Point:	574.934 °C at 760 mmHg
Flash Point:	289.061 °C
Hazard Symbols:	Xi
Risk Codes:	41
Safety:	26

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Specification

The 1,3,5-Tris(4-bromophenyl)benzene, with the CAS registry number 7511-49-1, belongs to the following product categories: Organic Electronics and Photonics; Synthetic Intermediates; Synthetic Tools and Reagents. And the molecular formula of the chemical is C₂₄H₁₅Br₃.

The characteristics of this chemical are as followings: (1)ACD/LogP: 9.33; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 9.332; (4)ACD/LogD (pH 7.4): 9.332; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 2841324; (8)ACD/KOC (pH 7.4): 2841324; (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: 1.659; (14)Molar Refractivity: 123.099 cm³; (15)Molar Volume: 333.842 cm³; (16)Polarizability: 48.8×10^-24cm³; (17)Surface Tension: 48.025 dyne/cm; (18)Density: 1.627 g/cm³; (19)Flash Point: 289.061 °C; (20)Enthalpy of Vaporization: 82.931 kJ/mol; (21)Boiling Point: 574.934 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You should be very cautious while dealing with this chemical. It has risk of serious damage to eyes, so if in case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: c1cc(ccc1c2cc(cc(c2)c3ccc(cc3)Br)c4ccc(cc4)Br)Br
(2)InChI: InChI=1/C24H15Br3/c25-22-7-1-16(2-8-22)19-13-20(17-3-9-23(26)10-4-17)15-21(14-19)18-5-11-24(27)12-6-18/h1-15H
(3)InChIKey: HJQRITCAXSBOPC-UHFFFAOYAA