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Molecule
Tripropyltin Chloride
CAS: 2279-76-7 · C9H21ClSn
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 2279-76-7
- Molecular Formula
- C9H21ClSn
- Molecular Mass
- 283.431 g/mol
Identifiers
CAS Registry Number
2279-76-7
SMILES
[CH2]CC.[CH2]CC.[CH2]CC.[Cl-].[Sn+]
InChI Key
FVFLIQMADUVDSP-UHFFFAOYSA-M
InChI
InChI=1S/3C3H7.ClH.Sn/c3*1-3-2;;/h3*1,3H2,2H3;1H;/q;;;;+1/p-1
Names and Synonyms
- Tripropyltin Chloride Common Name
- Stannane, chlorotripropyl- Synonym
- Tripropyltin chloride Synonym
- Tin, chlorotripropyl- Synonym
- Chlorotripropylstannane Synonym
- Tripropylstannyl chloride Synonym
- Tri-n-propyltin chloride Synonym
- Tripropylchlorostannane Synonym
- Chlorotripropyltin Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Density | 1.27 g/cm³ | CAS Common Chemistry |
| 1.2740 g/cm3 @ 20 °C | CAS Common Chemistry | |
| Canonical SMILES | Cl[Sn](CCC)(CCC)CCC | CAS Common Chemistry |
| InChI | InChI=1S/3C3H7.ClH.Sn/c3*1-3-2;;/h3*1,3H2,2H3;1H;/q;;;;+1/p-1 | CAS Common Chemistry |
| InChI Key | InChIKey=FVFLIQMADUVDSP-UHFFFAOYSA-M | CAS Common Chemistry |
| Melting Point | -23.5 °C | CAS Common Chemistry |
| Name | Tripropyltin chloride | CAS Common Chemistry |
| Molecular Mass | 283.431 g/mol | RDKit |
| 284.035373052 g/mol | RDKit | |
| 286.451 g/mol | chempirical lib | |
| Heavy Atom Count | 11 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | 0.31467000000000067 | RDKit |
| 0.3147 | RDKit | |
| Molar Refractivity | 52.698000000000036 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.6667 | RDKit |
| Exact Mass | 283.43 g/mol | CAS Common Chemistry |
| Boiling Point | 122-123 °C @ 10 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
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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 = 283.43 g/mol; density = 1.270 g/mL. Edit any field — others recompute live.
