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Dimethoxymethyl(3,3,3-Trifluoropropyl)Silane
CAS: 358-67-8 | C6H13F3O2Si
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
358-67-8
Molecular Formula:
C6H13F3O2Si
Molecular Mass:
202.25 g/mol
Names and Synonyms:
Dimethoxymethyl(3,3,3-Trifluoropropyl)Silane
Silane, dimethoxymethyl(3,3,3-trifluoropropyl)-
Dimethoxymethyl(3,3,3-trifluoropropyl)silane
T 2842
(3,3,3-Trifluoropropyl)(methyl)dimethoxysilane
LS 1080
3,3,3-Trifluoropropyldimethoxymethylsilane
Methyl(3,3,3-trifluoropropyl)dimethoxysilane
FD 1001
SiSiB PC 9711
PC 9711
Identifiers:
SMILES:
CO[Si](C)(CCC(F)(F)F)OC
InChI:
InChI=1S/C6H13F3O2Si/c1-10-12(3,11-2)5-4-6(7,8)9/h4-5H2,1-3H3
Key Properties
Boiling Point
118 °C
CAS Common Chemistry
Density
1.10 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 | 202.25 g/mol | CAS Common Chemistry |
| 202.24799999999996 g/mol | RDKit | |
| 202.063690846 g/mol | RDKit | |
| Density | 1.10 g/cm³ | CAS Common Chemistry |
| 1.1 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 118 °C | CAS Common Chemistry |
| Canonical SMILES | FC(F)(F)CC[Si](OC)(OC)C | CAS Common Chemistry |
| InChI | InChI=1S/C6H13F3O2Si/c1-10-12(3,11-2)5-4-6(7,8)9/h4-5H2,1-3H3 | CAS Common Chemistry |
| InChI Key | InChIKey=DIJRHOZMLZRNLM-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Dimethoxymethyl(3,3,3-trifluoropropyl)silane | CAS Common Chemistry |
| Heavy Atom Count | 12 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 18.46 Ų | RDKit |
| LogP | 2.3036000000000003 | RDKit |
| Molar Refractivity | 41.11500000000001 | RDKit |
