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Molecule
Hexamminecobalt(Iii) Chloride
CAS: 10534-89-1 · H18Cl3CoN6
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 10534-89-1
- Molecular Formula
- H18Cl3CoN6
- Molecular Mass
- 267.48 g/mol
Identifiers
CAS Registry Number
10534-89-1
SMILES
N.N.N.N.N.N.[Cl-].[Cl-].[Cl-].[Co+3]
InChI Key
JXBGZYGSWFSYFI-UHFFFAOYSA-K
InChI
InChI=1S/3ClH.Co.6H3N/h3*1H;;6*1H3/q;;;+3;;;;;;/p-3
Names and Synonyms
- Hexamminecobalt(Iii) Chloride Synonym
- Cobalt(3+), hexaammine-, chloride (1:3), (OC-6-11)- Synonym
- Cobalt(3+), hexaammine-, trichloride, (OC-6-11)- Synonym
- Cobalt(3+), hexaammine-, trichloride Synonym
- Hexaaminecobalt trichloride Synonym
- Cobalt-hexamine chloride Synonym
- Hexaamminecobalt chloride Synonym
- Hexaamminecobalt trichloride Synonym
- Hexaminecobalt(3+) trichloride Synonym
- Hexamminecobalt(III) chloride Synonym
- Hexaamminecobalt(3+) trichloride Synonym
- Hexaminocobaltic chloride Synonym
- Hexaaminecobalt(3+) trichloride Synonym
- Cobalt hexammine chloride Synonym
- Hexaamminecobalt(III) chloride Synonym
- Hexaamminetrichlorocobalt Synonym
- Cobalt hexaammine trichloride Synonym
- NSC 4317 Synonym
- Hexaamminecobalt(III) trichloride Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 267.48 g/mol | CAS Common Chemistry |
| 267.478 g/mol | RDKit | |
| 272.509 g/mol | chempirical lib | |
| Density | 1.74 g/cm³ | CAS Common Chemistry |
| 1.74 g/cm3 | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Hexamminecobalt(III)_chloride | CAS Common Chemistry |
| Canonical SMILES | [Cl-].[NH3][Co+3]([NH3])([NH3])([NH3])([NH3])[NH3] | CAS Common Chemistry |
| InChI | InChI=1S/3ClH.Co.6H3N/h3*1H;;6*1H3/q;;;+3;;;;;;/p-3 | CAS Common Chemistry |
| InChI Key | InChIKey=JXBGZYGSWFSYFI-UHFFFAOYSA-K | CAS Common Chemistry |
| Melting Point | 286 °C | CAS Common Chemistry |
| Name | Hexaamminecobalt(3+) trichloride | CAS Common Chemistry |
| Hexamminecobalt(III) chloride | CAS Common Chemistry | |
| Heavy Atom Count | 10 | RDKit |
| Hydrogen Bond Acceptors | 6 | RDKit |
| Hydrogen Bond Donors | 6 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 210.0 Ų | RDKit |
| LogP | -8.018500000000001 | RDKit |
| -8.0185 | RDKit | |
| Molar Refractivity | 30.132600000000025 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 265.999047616 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
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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.
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MW = 267.48 g/mol; density = 1.740 g/mL. Edit any field — others recompute live.
