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CAS No.: | 58160-99-9 |
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Name: | 3-Aminopropylsilanetriol |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C3H11NO3Si |
Molecular Weight: | 137.211 |
Synonyms: | Silanetriol,(3-aminopropyl)- (9CI);(g-Aminopropyl)silanetriol;3-Aminopropyltrihydroxysilane;SIA 0608.0;g-Aminopropyltrihydroxysilane;(3-Aminopropyl)silanetriol;Silanetriol, (3-aminopropyl)-;silanetriol, 1-(3-aminopropyl)-; |
EINECS: | 261-145-5 |
Density: | 1.248 g/cm3 |
Boiling Point: | 297.659 °C at 760 mmHg |
Flash Point: | 133.82 °C |
PSA: | 86.71000 |
LogP: | -1.04870 |
3-aminopropyltriethoxysilane
A
1-(3-aminopropyl)silantriol
Conditions | Yield |
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In water for 7h; pH=11; |
3-aminopropyltriethoxysilane
1-(3-aminopropyl)silantriol
Conditions | Yield |
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With water | |
With hydrogenchloride In water at 20℃; for 15h; | |
With hydrogenchloride In water at 45℃; | |
With water |
Conditions | Yield |
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With trifluoroacetic acid In water |
1-(3-aminopropyl)silantriol
Conditions | Yield |
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at 20℃; for 504000h; |
1-(3-aminopropyl)silantriol
Conditions | Yield |
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With PVC In water at 20℃; |
Conditions | Yield |
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In water for 0.5h; |
1,3-propanesultone
1-(3-aminopropyl)silantriol
Conditions | Yield |
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Stage #1: 1,3-propanesultone; 1-(3-aminopropyl)silantriol In water at 20℃; for 12.5h; Stage #2: With lithium hydroxide monohydrate; water at 50℃; for 4h; |
Conditions | Yield |
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Stage #1: sodium dihydrogenphosphate With di(n-butyl)tin oxide In cyclohexanone; isopropyl alcohol at 130℃; for 2.5h; Stage #2: 1-(3-aminopropyl)silantriol With di(n-butyl)tin oxide In cyclohexanone; isopropyl alcohol at 170℃; for 6h; Stage #3: methanol; molybdenum (III) chloride Further stages; |
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The Silanetriol,1-(3-aminopropyl)-, with the CAS registry number 58160-99-9 and EINECS registry number 261-145-5, has the systematic name of (3-aminopropyl)silanetriol. It belongs to the product category of Amino. And the molecular formula of the chemical is C3H11NO3Si.
The characteristics of Silanetriol,1-(3-aminopropyl)- are as followings: (1)ACD/LogP: 0.42; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -2.67; (4)ACD/LogD (pH 7.4): -2.36; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 5; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 30.93 Å2; (13)Index of Refraction: 1.508; (14)Molar Refractivity: 32.8 cm3; (15)Molar Volume: 109.9 cm3; (16)Polarizability: 13×10-24cm3; (17)Surface Tension: 48.2 dyne/cm; (18)Density: 1.247 g/cm3; (19)Flash Point: 133.8 °C; (20)Enthalpy of Vaporization: 62.36 kJ/mol; (21)Boiling Point: 297.7 °C at 760 mmHg; (22)Vapour Pressure: 0.000135 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O[Si](O)(O)CCCN
(2)InChI: InChI=1/C3H11NO3Si/c4-2-1-3-8(5,6)7/h5-7H,1-4H2
(3)InChIKey: JTXUAHIMULPXKY-UHFFFAOYAK