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CAS No.: | 41591-87-1 |
---|---|
Name: | TETRADECYLDIMETHYL(3-TRIMETHOXYSILYLPROPYL)AMMONIUM CHLORIDE |
Molecular Structure: | |
Formula: | C22H50ClNO3Si |
Molecular Weight: | 440.18 |
Synonyms: | 1-Tetradecanaminium,N,N-dimethyl-N-[3-(trimethoxysilyl)propyl]-, chloride (9CI);Dimethyltetradecyl[3-(trimethoxysilyl)propyl]ammonium chloride;SIT 7090;Sanitized T 99-19;TDTA;Tetradecyldimethyl(3-trimethoxysilylpropyl)ammoniumchloride; |
EINECS: | 255-451-8 |
Density: | 0.89 g/cm3 |
Boiling Point: | 68 °C |
Flash Point: | 12 °C (Methanol) |
Risk Codes: | R11; R23/24/25; R34 |
PSA: | 27.69000 |
LogP: | 3.03610 |
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The 1-Tetradecanaminium,N,N-dimethyl-N-[3-(trimethoxysilyl)propyl]-, chloride (1:1), with the CAS registry number 41591-87-1, is also known as 1-Tetradecanaminium, N,N-dimethyl-N-(3-(trimethoxysilyl)propyl)-, chloride. Its EINECS registry number is 255-451-8. This chemical's molecular formula is C22H50ClNO3Si and molecular weight is 440.18. Its IUPAC name is called dimethyl-tetradecyl-(3-trimethoxysilylpropyl)azanium chloride.
Physical properties of 1-Tetradecanaminium,N,N-dimethyl-N-[3-(trimethoxysilyl)propyl]-, chloride (1:1): (1)ACD/LogP: 0.98; (2)ACD/LogD (pH 5.5): 0.98; (3)ACD/LogD (pH 7.4): 0.98; (4)ACD/BCF (pH 5.5): 3.28; (5)ACD/BCF (pH 7.4): 3.28; (6)ACD/KOC (pH 5.5): 81.39; (7)ACD/KOC (pH 7.4): 81.39; (8)#H bond acceptors: 4; (9)#Freely Rotating Bonds: 20.
When you are using this chemical, please be cautious about it as the following:
This chemical is highly flammable. It is toxic by inhalation, in contact with skin and if swallowed. Besides, it may cause burns. You should keep 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)Canonical SMILES: CCCCCCCCCCCCCC[N+](C)(C)CCC[Si](OC)(OC)OC.[Cl-]
(2)InChI: InChI=1S/C22H50NO3Si.ClH/c1-7-8-9-10-11-12-13-14-15-16-17-18-20-23(2,3)21-19-22-27(24-4,25-5)26-6;/h7-22H2,1-6H3;1H/q+1;/p-1
(3)InChIKey: PHDAZHGCTGTQAS-UHFFFAOYSA-M