Back to Search
Molecule
1-Butanol, Antimony(3+) Salt (3:1)
CAS: 2155-74-0 · C4H10OSb
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 2155-74-0
- Molecular Formula
- C4H10OSb
- Molecular Mass
- 195.88 g/mol
Identifiers
CAS Registry Number
2155-74-0
SMILES
CCCCO.[Sb]
InChI Key
KDZDLLGMUHLMRZ-UHFFFAOYSA-N
InChI
InChI=1S/C4H10O.Sb/c1-2-3-4-5;/h5H,2-4H2,1H3;
Names and Synonyms
- 1-Butanol, Antimony(3+) Salt (3:1) Synonym
- 1-Butanol, antimony(3+) salt (3:1) Synonym
- Antimonic acid (H3SbO3), tributyl ester Synonym
- 1-Butanol, antimony(3+) salt Synonym
- Butyl antimonate(III) Synonym
- Tributoxyantimony Synonym
- Antimony tributoxide Synonym
- Tributoxystibine Synonym
- Tributylantimonite Synonym
- Antimony butoxide Synonym
- Alcofine SB 40 Synonym
- Antimony(III) butoxide Synonym
- Butyl antimonite ((BuO)3Sb) Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 195.88 g/mol | CAS Common Chemistry |
| 195.88299999999998 g/mol | RDKit | |
| 195.883 g/mol | RDKit | |
| 198.907 g/mol | chempirical lib | |
| Density | 1.28 g/cm³ | CAS Common Chemistry |
| 1.2804 g/cm3 @ 20 °C | CAS Common Chemistry | |
| Canonical SMILES | [Sb].OCCCC | CAS Common Chemistry |
| InChI | InChI=1S/C4H10O.Sb/c1-2-3-4-5;/h5H,2-4H2,1H3; | CAS Common Chemistry |
| InChI Key | InChIKey=KDZDLLGMUHLMRZ-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 1-Butanol, antimony(3+) salt (3:1) | CAS Common Chemistry |
| Heavy Atom Count | 6 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 20.23 Ų | RDKit |
| LogP | 0.39799999999999996 | RDKit |
| 0.398 | RDKit | |
| Molar Refractivity | 27.747799999999987 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 194.97698064 g/mol | RDKit |
| Boiling Point | 138.5-139.5 °C @ 5.5 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 = 195.88 g/mol; density = 1.280 g/mL. Edit any field — others recompute live.
