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CAS No.: | 2895-07-0 |
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Name: | 1,1,1,3,3,5,5-HEPTAMETHYLTRISILOXANE |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C7H22O2Si3 |
Molecular Weight: | 222.507 |
Synonyms: | 1,1,1,3,3,5,5-Heptamethyltrisiloxane;Heptamethyltrisiloxane; |
EINECS: | 220-774-5 |
Density: | 0.82 |
Boiling Point: | 163.8 °C at 760 mmHg |
Flash Point: | 52.8 °C |
Risk Codes: | 10-36/37/38 |
Safety: | 16-33-36/37/39 |
PSA: | 18.46000 |
LogP: | 2.53970 |
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The Trisiloxane,1,1,1,3,3,5,5-heptamethyl-, with the CAS registry number 2895-07-0, is also known as Heptamethyltrisiloxane. Its EINECS registry number is 220-774-5. This chemical's molecular formula is C7H22O2Si3 and molecular weight is 222.5. Its IUPAC name is called 1,1,1,3,3,5,5-heptamethyltrisiloxane.
Physical properties of Trisiloxane,1,1,1,3,3,5,5-heptamethyl-: (1)ACD/LogP: 5.32; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.32; (4)ACD/LogD (pH 7.4): 5.32; (5)ACD/BCF (pH 5.5): 6517.53; (6)ACD/BCF (pH 7.4): 6517.53; (7)ACD/KOC (pH 5.5): 18694.43; (8)ACD/KOC (pH 7.4): 18694.43; (9)#H bond acceptors: 2; (10)#Freely Rotating Bonds: 4; (11)Flash Point: 52.8 °C; (12)Enthalpy of Vaporization: 38.38 kJ/mol; (13)Boiling Point: 163.8 °C at 760 mmHg; (14)Vapour Pressure: 2.66 mmHg at 25°C.
Uses of Trisiloxane,1,1,1,3,3,5,5-heptamethyl-: it can be used to produce 11-(1,1,1,3,3,5,5-hetamethyltrisiloxanyl)undecanol at temperature of 60 °C. This reaction will need reagent dicyclopentadienylplatinium(II) chloride and solvent tetrahydrofuran with reaction time of 24 hours. The yield is about 97%.
When you are using this chemical, please be cautious about it as the following:
This chemical is flammable. It is irritating to eyes, respiratory system and skin. You should keep it away from sources of ignition - No smoking. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)SMILES: O([Si](C)(C)C)[Si](O[SiH](C)C)(C)C
(2)InChI: InChI=1/C7H22O2Si3/c1-10(2)8-12(6,7)9-11(3,4)5/h10H,1-7H3
(3)InChIKey: MWYMHZINPCTWSB-UHFFFAOYAX