CAS No.180006-15-9,N-OCTYLPENTAMETHYLDISILOXANE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	180006-15-9
Name:	N-OCTYLPENTAMETHYLDISILOXANE
Article Data:	14

Formula:	C₁₃H₃₂OSi₂
Molecular Weight:	260.567
Synonyms:	Disiloxane,pentamethyloctyl- (9CI);
Density:	0.811 g/cm³
Boiling Point:	238.2 °C at 760 mmHg
Flash Point:	86.7 °C
Appearance:	clear colorless liquid
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	37/39-26
PSA:	9.23000
LogP:	5.40350

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Specification

This chemical is called Disiloxane, 1,1,1,3,3-pentamethyl-3-octyl-, and its systematic name is 1,1,1,3,3-pentamethyl-3-octyldisiloxane. With the molecular formula of C₁₃H₃₂OSi₂, its molecular weight is 260.56. The CAS registry number of this chemical is 180006-15-9.

Other characteristics of the Disiloxane, 1,1,1,3,3-pentamethyl-3-octyl- can be summarised as followings: (1)ACD/LogP: 7.92; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.92; (4)ACD/LogD (pH 7.4): 7.92; (5)ACD/BCF (pH 5.5): 619759.19; (6)ACD/BCF (pH 7.4): 619759.19; (7)ACD/KOC (pH 5.5): 487129.03; (8)ACD/KOC (pH 7.4): 487129.03; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.421; (14)Molar Refractivity: 81.45 cm³; (15)Molar Volume: 320.9 cm³; (16)Polarizability: 32.29×10^-24cm³; (17)Surface Tension: 21 dyne/cm; (18)Density: 0.811 g/cm³; (19)Flash Point: 86.7 °C; (20)Enthalpy of Vaporization: 45.57 kJ/mol; (21)Boiling Point: 238.2 °C at 760 mmHg; (22)Vapour Pressure: 0.0663 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: O([Si](C)(C)C)[Si](CCCCCCCC)(C)C
2.InChI: InChI=1/C13H32OSi2/c1-7-8-9-10-11-12-13-16(5,6)14-15(2,3)4/h7-13H2,1-6H3
3.InChIKey: VDVBVLLRBRJINF-UHFFFAOYAQ