CAS No.31323-44-1,OCTACHLOROTRISILOXANE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	31323-44-1
Name:	OCTACHLOROTRISILOXANE

Formula:	Cl₈O₂Si₃
Molecular Weight:	399.879
Synonyms:	Trisiloxane,octachloro- (6CI,8CI,9CI);Octachlorotrisiloxane;octachlorotrisiloxanato;trisiloxane, 1,1,1,3,3,5,5,5-octachloro-;Trisiloxane, octachloro-;
EINECS:	250-570-1
Density:	1.669g/cm³
Melting Point:	-47°C
Boiling Point:	195 °C at 760 mmHg
Risk Codes:	14-34
Safety:	26-36/37/39
Transport Information:	2987
PSA:	18.46000
LogP:	4.23680

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Specification

The Trisiloxane,1,1,1,3,3,5,5,5-octachloro-, with the CAS registry number 31323-44-1 and EINECS registry number 250-570-1, has the systematic name of octachlorotrisiloxanato. And the molecular formula of the chemical is Cl₈O₂Si₃.

The characteristics of Trisiloxane,1,1,1,3,3,5,5,5-octachloro- are as followings: (1)ACD/LogP: 12.80; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 12.8; (4)ACD/LogD (pH 7.4): 12.8; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)#H bond acceptors: 2; (8)#H bond donors: 0; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 18.46 Å²; (11)Index of Refraction: 1.5; (12)Molar Refractivity: 70.48 cm³; (13)Molar Volume: 239.5 cm³; (14)Polarizability: 27.94×10^-24cm³; (15)Surface Tension: 29.1 dyne/cm; (16)Density: 1.669 g/cm³; (17)Enthalpy of Vaporization: 41.36 kJ/mol; (18)Boiling Point: 195 °C at 760 mmHg; (19)Vapour Pressure: 0.6 mmHg at 25°C.

You should be cautious while dealing with this chemical. It reacts violently with water, and may cause burns. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection, and if in case of contacting 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: Cl[Si](Cl)(Cl)O[Si](Cl)(Cl)O[Si](Cl)(Cl)Cl
(2)InChI: InChI=1/Cl8O2Si3/c1-11(2,3)9-13(7,8)10-12(4,5)6
(3)InChIKey: CLXMTJZPFVPWAX-UHFFFAOYAX