Back to Search
Molecule
3,3′-(1,1,3,3-Tetramethyl-1,3-Disiloxanediyl)Bis[1-Propanol]
CAS: 18001-97-3 · C10H26O3Si2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 18001-97-3
- Molecular Formula
- C10H26O3Si2
- Molecular Mass
- 250.49 g/mol
Identifiers
CAS Registry Number
18001-97-3
SMILES
C[Si](C)(CCCO)O[Si](C)(C)CCCO
InChI Key
ISPWSRVEMSGMKS-UHFFFAOYSA-N
InChI
InChI=1S/C10H26O3Si2/c1-14(2,9-5-7-11)13-15(3,4)10-6-8-12/h11-12H,5-10H2,1-4H3
Names and Synonyms
- 3,3′-(1,1,3,3-Tetramethyl-1,3-Disiloxanediyl)Bis[1-Propanol] Synonym
- 1-Propanol, 3,3′-(1,1,3,3-tetramethyl-1,3-disiloxanediyl)bis- Synonym
- 5-Oxa-4,6-disilanonane-1,9-diol, 4,4,6,6-tetramethyl- Synonym
- 3,3′-(1,1,3,3-Tetramethyl-1,3-disiloxanediyl)bis[1-propanol] Synonym
- 1,3-Bis(γ-hydroxypropyl)-1,1,3,3-tetramethyldisiloxane Synonym
- 1,3-Bis(3-hydroxypropyl)-1,1,3,3-tetramethyldisiloxane Synonym
- 1,3-Bis(3-hydroxypropyl)tetramethyldisiloxane Synonym
- 1,3-Di(3-hydroxypropyl) 1,1,3,3-tetramethyl disiloxane Synonym
- 3,3′-(1,1,3,3-Tetramethyldisiloxane-1,3-diyl)bis(propan-1-ol) Synonym
- 3-[[3-Hydroxypropyl(dimethyl)silyl]oxy-dimethylsilyl]propan-1-ol Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 250.49 g/mol | CAS Common Chemistry |
| 250.48699999999997 g/mol | RDKit | |
| 250.487 g/mol | RDKit | |
| Density | 0.95 g/cm³ | CAS Common Chemistry |
| 0.953 g/cm3 @ 25 °C | CAS Common Chemistry | |
| Canonical SMILES | OCCC[Si](O[Si](C)(C)CCCO)(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C10H26O3Si2/c1-14(2,9-5-7-11)13-15(3,4)10-6-8-12/h11-12H,5-10H2,1-4H3 | CAS Common Chemistry |
| InChI Key | InChIKey=ISPWSRVEMSGMKS-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 3,3′-(1,1,3,3-Tetramethyl-1,3-disiloxanediyl)bis[1-propanol] | CAS Common Chemistry |
| Heavy Atom Count | 15 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 8 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 49.69 Ų | RDKit |
| LogP | 2.1780000000000004 | RDKit |
| 2.178 | RDKit | |
| Molar Refractivity | 69.06860000000005 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 250.142047752 g/mol | RDKit |
| Boiling Point | 75 °C @ 20 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
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.
External Resources
Convert
Quick conversion
MW = 250.49 g/mol; density = 0.950 g/mL. Edit any field — others recompute live.
