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N-[(Dimethoxymethylsilyl)Methyl]Benzenamine
CAS: 17890-10-7 | C10H17NO2Si
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
17890-10-7
Molecular Formula:
C10H17NO2Si
Molecular Mass:
211.34 g/mol
Names and Synonyms:
N-[(Dimethoxymethylsilyl)Methyl]Benzenamine
Benzenamine, N-[(dimethoxymethylsilyl)methyl]-
Aniline, N-[(dimethoxymethylsilyl)methyl]-
N-[(Dimethoxymethylsilyl)methyl]benzenamine
N-Phenylaminomethyldimethoxymethylsilane
Geniosil XL 972
XL 972
(Anilinomethyl)(dimethoxy)(methyl)silane
(N-Phenylaminomethyl)methyldimethoxysilane
(Methyl)(phenylaminomethyl)dimethoxysilane
α-N-Phenylaminomethyldimethoxymethylsilane
Anilinomethylmethyldimethoxysilane
Identifiers:
SMILES:
CO[Si](C)(CNc1ccccc1)OC
InChI:
InChI=1S/C10H17NO2Si/c1-12-14(3,13-2)9-11-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3
Key Properties
Boiling Point
255 °C
CAS Common Chemistry
Density
1.04 g/cm³
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 211.34 g/mol | CAS Common Chemistry |
| 211.33700000000002 g/mol | RDKit | |
| 211.102855314 g/mol | RDKit | |
| Density | 1.04 g/cm³ | CAS Common Chemistry |
| 1.04 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 255 °C | CAS Common Chemistry |
| Canonical SMILES | O(C)[Si](OC)(C)CNC=1C=CC=CC1 | CAS Common Chemistry |
| InChI | InChI=1S/C10H17NO2Si/c1-12-14(3,13-2)9-11-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3 | CAS Common Chemistry |
| InChI Key | InChIKey=BNQFLOSSLHYGLQ-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | N-[(Dimethoxymethylsilyl)methyl]benzenamine | CAS Common Chemistry |
| Heavy Atom Count | 14 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 5 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 30.49 Ų | RDKit |
| LogP | 2.0024999999999995 | RDKit |
| Molar Refractivity | 60.56770000000004 | RDKit |
