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Molecule
3-(Trimethylsilyl)-1-Propanol
CAS: 2917-47-7 · C6H16OSi
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 2917-47-7
- Molecular Formula
- C6H16OSi
- Molecular Mass
- 132.28 g/mol
Identifiers
CAS Registry Number
2917-47-7
SMILES
C[Si](C)(C)CCCO
InChI Key
YNUUCDHAZGAVEZ-UHFFFAOYSA-N
InChI
InChI=1S/C6H16OSi/c1-8(2,3)6-4-5-7/h7H,4-6H2,1-3H3
Names and Synonyms
- 3-(Trimethylsilyl)-1-Propanol Synonym
- 1-Propanol, 3-(trimethylsilyl)- Synonym
- 3-(Trimethylsilyl)-1-propanol Synonym
- 3-(Trimethylsilyl)propanol Synonym
- 3-Hydroxypropyltrimethylsilane Synonym
- 3-(Trimethylsilyl)propyl alcohol Synonym
- 1-(Trimethylsilyl)-3-propanol Synonym
- NSC 96794 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 132.28 g/mol | CAS Common Chemistry |
| 132.279 g/mol | RDKit | |
| Density | 0.08 g/cm³ | CAS Common Chemistry |
| 0.0832 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 141 °C | CAS Common Chemistry |
| Canonical SMILES | OCCC[Si](C)(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C6H16OSi/c1-8(2,3)6-4-5-7/h7H,4-6H2,1-3H3 | CAS Common Chemistry |
| InChI Key | InChIKey=YNUUCDHAZGAVEZ-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 3-(Trimethylsilyl)-1-propanol | CAS Common Chemistry |
| Heavy Atom Count | 8 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 20.23 Ų | RDKit |
| LogP | 1.7069999999999999 | RDKit |
| 1.707 | RDKit | |
| Molar Refractivity | 39.8558 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 132.097041662 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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8
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3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
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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.
External Resources
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MW = 132.28 g/mol; density = 0.080 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C6H16OSi.
