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Molecule
N-Phenyl-3-Aminopropyltrimethoxysilane
CAS: 3068-76-6 · C12H21NO3Si
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 3068-76-6
- Molecular Formula
- C12H21NO3Si
- Molecular Mass
- 255.39 g/mol
Identifiers
CAS Registry Number
3068-76-6
SMILES
CO[Si](CCCNc1ccccc1)(OC)OC
InChI Key
KBJFYLLAMSZSOG-UHFFFAOYSA-N
InChI
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
Names and Synonyms
- N-Phenyl-3-Aminopropyltrimethoxysilane Synonym
- Benzenamine, N-[3-(trimethoxysilyl)propyl]- Synonym
- Aniline, N-[3-(trimethoxysilyl)propyl]- Synonym
- Silane, (3-anilinopropyl)trimethoxy- Synonym
- N-[3-(Trimethoxysilyl)propyl]benzenamine Synonym
- Y 5669 Synonym
- Trimethoxy[3-(phenylamino)propyl]silane Synonym
- P 0156 Synonym
- (γ-Anilinopropyl)trimethoxysilane Synonym
- γ-[(Phenylamino)propyl]trimethoxysilane Synonym
- 3-(N-Phenylaminopropyl)trimethoxysilane Synonym
- KBM 573 Synonym
- (N-Phenyl-γ-aminopropyl)trimethoxysilane Synonym
- SZ 6083 Synonym
- 3-(Phenylaminopropyl)trimethoxysilane Synonym
- Y 9669 Synonym
- N-[3-(Trimethoxysilyl)propyl]aniline Synonym
- (3-Anilinopropyl)trimethoxysilane Synonym
- Silquest Y 9669 Synonym
- A 9669 Synonym
- Y 6996 Synonym
- N-Phenyl-3-aminopropyltrimethoxysilane Synonym
- U 141 Synonym
- Z 6883 Synonym
- SIP 6724.0 Synonym
- Phenylaminopropyltrimethoxysilane Synonym
- CF 4083 Synonym
- γ-Anilinopropyltrimethoxysilane Synonym
- γ-N-Phenylaminopropyltrimethoxysilane Synonym
- XS 1075 Synonym
- X 12-1191 Synonym
- UP 908 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 255.39 g/mol | CAS Common Chemistry |
| 255.39000000000001 g/mol | RDKit | |
| Density | 1.07 g/cm³ | CAS Common Chemistry |
| 1.070 g/cm3 | CAS Common Chemistry | |
| Canonical SMILES | O(C)[Si](OC)(OC)CCCNC=1C=CC=CC1 | CAS Common Chemistry |
| InChI | 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 | CAS Common Chemistry |
| InChI Key | InChIKey=KBJFYLLAMSZSOG-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | N-Phenyl-3-aminopropyltrimethoxysilane | CAS Common Chemistry |
| Heavy Atom Count | 17 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 8 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 39.72 Ų | RDKit |
| LogP | 2.3667 | RDKit |
| Molar Refractivity | 71.13670000000005 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.5 | RDKit |
| Exact Mass | 255.129070062 g/mol | RDKit |
| Boiling Point | 132-135 °C @ 0.3 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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200 ppm
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| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
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MW = 255.39 g/mol; density = 1.070 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C12H21NO3Si.
