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Molecule
Platinum(Ii) Bis(Acetylacetonate)
CAS: 15170-57-7 · C10H14O4Pt
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 15170-57-7
- Molecular Formula
- C10H14O4Pt
- Molecular Mass
- 393.30 g/mol
Identifiers
CAS Registry Number
15170-57-7
SMILES
CC(=O)[CH-]C(C)=O.CC(=O)[CH-]C(C)=O.[Pt+2]
InChI Key
TUOYDQBYTHSWNN-UHFFFAOYSA-N
InChI
InChI=1S/2C5H7O2.Pt/c2*1-4(6)3-5(2)7;/h2*3H,1-2H3;/q2*-1;+2
Names and Synonyms
- Platinum(Ii) Bis(Acetylacetonate) Synonym
- Platinum, bis(2,4-pentanedionato-κO2,κO4)-, (SP-4-1)- Synonym
- Platinum, bis(2,4-pentanedionato)- Synonym
- Platinum, bis(2,4-pentanedionato-O,O′)-, (SP-4-1)- Synonym
- Platinum, bis(2,4-pentanedionato-κO,κO′)-, (SP-4-1)- Synonym
- (SP-4-1)-Bis(2,4-pentanedionato-κO2,κO4)platinum Synonym
- Platinum acetylacetonate Synonym
- Platinum bis(acetylacetonate) Synonym
- Bis(acetylacetonato)platinum Synonym
- Bis(2,4-pentanedionato)platinum Synonym
- Platinum(2+) acetylacetonate Synonym
- Platinum(II) acetylacetonate Synonym
- Bis(acetylacetonato)platinum(II) Synonym
- Pt(acac)2 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 393.30 g/mol | CAS Common Chemistry |
| 393.296 g/mol | RDKit | |
| 397.334 g/mol | chempirical lib | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Platinum(II)_bis(acetylacetonate) | CAS Common Chemistry |
| Canonical SMILES | O1=C([CH-]C(=O[Pt+2]12O=C([CH-]C(=O2)C)C)C)C | CAS Common Chemistry |
| InChI | InChI=1S/2C5H7O2.Pt/c2*1-4(6)3-5(2)7;/h2*3H,1-2H3;/q2*-1;+2 | CAS Common Chemistry |
| InChI Key | InChIKey=TUOYDQBYTHSWNN-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 239.4 °C (decomp) | CAS Common Chemistry |
| Name | Platinum acetylacetonate | CAS Common Chemistry |
| Heavy Atom Count | 15 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 68.28 Ų | RDKit |
| LogP | 0.73488 | RDKit |
| 0.7349 | RDKit | |
| Molar Refractivity | 51.32400000000003 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.4 | RDKit |
| Exact Mass | 393.054000028 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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| Shift (ppm) | Multiplicity | Integration | Assignment |
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200 ppm
180
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| 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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MW = 393.30 g/mol. Edit any field — others recompute live.
