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Molecule
N,N,N′,N′-Tetramethyl-N′′-[3-(Trimethoxysilyl)Propyl]Guanidine
CAS: 69709-01-9 · C11H27N3O3Si
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 69709-01-9
- Molecular Formula
- C11H27N3O3Si
- Molecular Mass
- 277.44 g/mol
Identifiers
CAS Registry Number
69709-01-9
SMILES
CO[Si](CCCN=C(N(C)C)N(C)C)(OC)OC
InChI Key
ZUEIRGBMFHHKAC-UHFFFAOYSA-N
InChI
InChI=1S/C11H27N3O3Si/c1-13(2)11(14(3)4)12-9-8-10-18(15-5,16-6)17-7/h8-10H2,1-7H3
Names and Synonyms
- N,N,N′,N′-Tetramethyl-N′′-[3-(Trimethoxysilyl)Propyl]Guanidine Systematic Name
- Guanidine, N,N,N′,N′-tetramethyl-N′′-[3-(trimethoxysilyl)propyl]- Synonym
- N,N,N′,N′-Tetramethyl-N′′-[3-(trimethoxysilyl)propyl]guanidine Synonym
- N′′-[3-(Trimethoxysilyl)propyl]tetramethylguanidine Synonym
- (Trimethoxysilylpropyl)tetramethylguanidine Synonym
- N-[Bis(dimethylamino)methylene]-3-(trimethoxysilyl)propylamine Synonym
- 1,1,3,3-Tetramethyl-2-(3-trimethoxysilylpropyl)guanidine Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 277.44 g/mol | CAS Common Chemistry |
| 277.44100000000003 g/mol | RDKit | |
| 277.441 g/mol | RDKit | |
| Canonical SMILES | N(=C(N(C)C)N(C)C)CCC[Si](OC)(OC)OC | CAS Common Chemistry |
| InChI | InChI=1S/C11H27N3O3Si/c1-13(2)11(14(3)4)12-9-8-10-18(15-5,16-6)17-7/h8-10H2,1-7H3 | CAS Common Chemistry |
| InChI Key | InChIKey=ZUEIRGBMFHHKAC-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | N,N,N′,N′-Tetramethyl-N′′-[3-(trimethoxysilyl)propyl]guanidine | CAS Common Chemistry |
| Heavy Atom Count | 18 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 7 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 46.53 Ų | RDKit |
| 46.07 Ų | chempirical lib | |
| LogP | 0.7338000000000007 | RDKit |
| 0.7338 | RDKit | |
| Molar Refractivity | 75.88100000000006 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.9091 | RDKit |
| 0.91 | chempirical lib | |
| Exact Mass | 277.18216825400003 g/mol | RDKit |
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 = 277.44 g/mol. Edit any field — others recompute live.
