ChemicalBook--->CAS DataBase List--->3068-76-6

3068-76-6

3068-76-6 Structure

3068-76-6 Structure
IdentificationMore
[Name]

N-[3-(TRIMETHOXYSILYL)PROPYL]ANILINE
[CAS]

3068-76-6
[Synonyms]

(3-ANILINOPROPYL)TRIMETHOXYSILANE
3-(PHENYLAMINO)PROPYLTRIMETHOXYSILANE
N-[3-(TRIMETHOXYSILYL)PROPYL]ANILINE
N-PHENYL-3-AMINOPROPYLTRIMETHOXYSILANE
N-PHENYLAMINOPROPYLTRIMETHOXYSILANE
TRIMETHOXY[3-(PHENYLAMINO)PROPYL]SILANE
ZERENEX ZX007472
N-[.gamma.-(Trimethoxysilyl)propyl]aniline
n-[3-(trimethoxysilyl)propyl]-benzenamin
N-[3-(trimethoxysilyl)propyl]-Benzenamine
N-Phenyl-Gamma-Aminopropyltrim
Benzenamine, N-3-(trimethoxysilyl)propyl-
Phenylaminopropyltrimethoxysilane
(3-Anilinopropyl)trimethoxysilane, N-[3-(Trimethoxysilyl)propyl]aniline, [3-(Phenylamino)propyl]trimethoxysilane, Trimethoxy[3-(phenylamino)propyl]silane
(3-Anilinopropyl)trimethoxysilane, N-[3-(Trimethoxysilyl)propyl]aniline, [3-(Phenylamino)propyl]trimethoxysilane
N-Phenyl-3-(trimethoxysilyl)propane-1-amine
SZ-6083
Y-9669
[EINECS(EC#)]

221-328-2
[Molecular Formula]

C12H21NO3Si
[MDL Number]

MFCD00053673
[Molecular Weight]

255.39
[MOL File]

3068-76-6.mol
Chemical PropertiesBack Directory
[Appearance]

Yellowish clear liquid
[Melting point ]

<0°C
[Boiling point ]

310 °C(lit.)
[density ]

1.07 g/mL at 25 °C(lit.)
[vapor pressure ]

0-0.042Pa at 25℃
[refractive index ]

n20/D 1.506(lit.)
[Fp ]

>230 °F
[storage temp. ]

2-8°C, protect from light
[form ]

liquid
[pka]

5.02±0.50(Predicted)
[color ]

Colorless to Light yellow to Light orange
[Specific Gravity]

1.07
[Water Solubility ]

993-1000000mg/L at 20℃
[Hydrolytic Sensitivity]

7: reacts slowly with moisture/water
[Sensitive ]

Moisture Sensitive
[BRN ]

8620045
[InChI]

1S/C12H21NO3Si/c1-14-17(15-2,16-3)11-7-10-13-12-8-5-4-6-9-12/h4-6,8-9,13H,7,10-11H2,1-3H3
[InChIKey]

KBJFYLLAMSZSOG-UHFFFAOYSA-N
[SMILES]

CO[Si](CCCNc1ccccc1)(OC)OC
[LogP]

-0.6-2.5
[CAS DataBase Reference]

3068-76-6(CAS DataBase Reference)
[EPA Substance Registry System]

3068-76-6(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)Exclamation Mark (GHS07)Health Hazard (GHS08)
GHS05,GHS07,GHS08
[Signal word ]

Danger
[Hazard statements ]

H314-H317-H341-H351-H372-H412
[Precautionary statements ]

P202-P273-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338
[Hazard Codes ]

C
[Risk Statements ]

R34:Causes burns.
R40:Limited evidence of a carcinogenic effect.
R48/20/21/22:Harmful: danger of serious damage to health by prolonged exposure through inhalation, and in contact with skin and if swallowed .
R52/53:Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
[RIDADR ]

UN 3267 8/PG 2
[WGK Germany ]

1
[TSCA ]

Yes
[REACH Registrations]

Inactive
[HazardClass ]

8
[PackingGroup ]

III
[HS Code ]

29319090
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Aquatic Chronic 3
Carc. 2
Eye Dam. 1
Muta. 2
Skin Corr. 1B
Skin Sens. 1
STOT RE 1
Hazard InformationBack Directory
[Chemical Properties]

Yellowish clear liquid
[Uses]

TMSPA is a monomer which can be polymerized to form poly(TMPSA). Poly(TMPSA) can be used to coat gold nanorods (AuNRs) to fabricate an electrode for the sensing of hydrogen peroxide.
[General Description]

N-(3-(Trimethoxysilyl)propyl)aniline (TMSPA) is an organoalkoxysilane derivative of polyaniline (PAN). TMSPA is a pH sensitive silica-polyaniline hybrid which is electroactive and electrochromic in nature. It is used as a silane coupling agent.
[Synthesis]

Aniline

62-53-3

3-Chloropropyltrimethoxysilane

2530-87-2

N-[3-(TRIMETHOXYSILYL)PROPYL]ANILINE

3068-76-6

General procedure for the synthesis of N-phenyl-3-aminopropyltrimethoxysilane from aniline and 3-chloropropyltrimethoxysilane: 186 g of aniline and 182 g of polyaniline were added to the reactor. Subsequently, 198.7 g of 3-chloropropyltrimethoxysilane was added slowly and continuously dropwise to the reactor. During the reaction, the reaction temperature was maintained at 160 °C and the reaction was continuously stirred for 2 hours. After completion of the reaction, the reaction conditions were continued for 3 hours to ensure complete reaction. At the end of the reaction, the reaction mixture was separated by filtration to afford 229.8 g of N-phenyl-3-aminopropyltrimethoxysilane in 90.1% yield and 94.2% selectivity. Subsequently, the solid phase product was neutralized with ammonia and washed repeatedly with deionized water until the pH of the filtrate reached 6-7. Finally, the product was dried under vacuum at 80 °C to ensure that the moisture content did not exceed 1%. The dried product can be recycled as an acid scavenger.

[References]

[1] Patent: CN105481890, 2016, A. Location in patent: Paragraph 0015
[2] Doklady Chemistry, 2000, vol. 375, # 1-3, p. 250 - 252
Spectrum DetailBack Directory
[Spectrum Detail]

N-[3-(TRIMETHOXYSILYL)PROPYL]ANILINE(3068-76-6)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

3-(Phenylamino)propyltrimethoxysilane, 96%(3068-76-6)
[Sigma Aldrich]

3068-76-6(sigmaaldrich)
[TCI AMERICA]

Trimethoxy[3-(phenylamino)propyl]silane,>98.0%(GC)(3068-76-6)
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