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Molecule
3,3,3-Trifluoropropyldimethylchlorosilane
CAS: 1481-41-0 · C5H10ClF3Si
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 1481-41-0
- Molecular Formula
- C5H10ClF3Si
- Molecular Mass
- 190.67 g/mol
Identifiers
CAS Registry Number
1481-41-0
SMILES
C[Si](C)(Cl)CCC(F)(F)F
InChI Key
KBAZUXSLKGQRJF-UHFFFAOYSA-N
InChI
InChI=1S/C5H10ClF3Si/c1-10(2,6)4-3-5(7,8)9/h3-4H2,1-2H3
Names and Synonyms
- 3,3,3-Trifluoropropyldimethylchlorosilane Synonym
- Silane, chlorodimethyl(3,3,3-trifluoropropyl)- Synonym
- Chlorodimethyl(3,3,3-trifluoropropyl)silane Synonym
- 3,3,3-Trifluoropropyldimethylchlorosilane Synonym
- (3,3,3-Trifluoropropyl)dimethylsilyl chloride Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 190.67 g/mol | CAS Common Chemistry |
| 190.66799999999998 g/mol | RDKit | |
| 190.668 g/mol | RDKit | |
| 190.665 g/mol | chempirical lib | |
| Density | 1.11 g/cm³ | CAS Common Chemistry |
| 1.113 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 118 °C | CAS Common Chemistry |
| Canonical SMILES | FC(F)(F)CC[Si](Cl)(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C5H10ClF3Si/c1-10(2,6)4-3-5(7,8)9/h3-4H2,1-2H3 | CAS Common Chemistry |
| InChI Key | InChIKey=KBAZUXSLKGQRJF-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 3,3,3-Trifluoropropyldimethylchlorosilane | CAS Common Chemistry |
| Heavy Atom Count | 10 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | 3.3827000000000016 | RDKit |
| 3.3827 | RDKit | |
| Molar Refractivity | 38.814000000000014 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 190.01923919 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
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20
0 ppm
| 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.
External Resources
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Quick conversion
MW = 190.67 g/mol; density = 1.110 g/mL. Edit any field — others recompute live.
