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Molecule
Citoplax
CAS: 15663-27-1 · H6Cl2N2Pt
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 15663-27-1
- Molecular Formula
- H6Cl2N2Pt
- Molecular Mass
- 300.05 g/mol
Identifiers
CAS Registry Number
15663-27-1
SMILES
N.N.[Cl-].[Cl-].[Pt+2]
InChI Key
LXZZYRPGZAFOLE-UHFFFAOYSA-L
InChI
InChI=1S/2ClH.2H3N.Pt/h2*1H;2*1H3;/q;;;;+2/p-2
Names and Synonyms
- Citoplax Synonym
- Cisplatin Synonym
- Platinum, diamminedichloro-, (SP-4-2)- Synonym
- Platinum, diamminedichloro-, cis- Synonym
- (SP-4-2)-Diamminedichloroplatinum Synonym
- cis-Diamminedichloroplatinum Synonym
- cis-Dichlorodiamineplatinum(II) Synonym
- cis-Platinum(II) diaminodichloride Synonym
- cis-Platinum(II) diamminedichloride Synonym
- cis-Dichlorodiammineplatinum Synonym
- cis-Platinous diaminodichloride Synonym
- cis-Platinum diaminodichloride Synonym
- cis-Platinumdiammine dichloride Synonym
- cis-Platinumdiamine dichloride Synonym
- cis-Diaminodichloroplatinum(II) Synonym
- NSC 119875 Synonym
- Cisplatin Synonym
- cis-Platinum II Synonym
- Platinol Synonym
- Neoplatin Synonym
- cis-Platine Synonym
- Biocisplatinum Synonym
- cis-DDP Synonym
- cis-Diamminedichloroplatinum(II) Synonym
- Platidiam Synonym
- cis-Platinum Synonym
- Cisplatinum Synonym
- CPDD Synonym
- cis-Platin Synonym
- cis-Dichlorodiammineplatinum(II) Synonym
- TR 170 Synonym
- CDDP Synonym
- DDP Synonym
- CPPD Synonym
- cis-Diaminedichloroplatinum(II) Synonym
- Cisplatyl Synonym
- Briplatin Synonym
- DDP (antitumor agent) Synonym
- Abiplatin Synonym
- SPI 077 Synonym
- CACP Synonym
- Lederplatin Synonym
- Platosin Synonym
- Platamine Synonym
- Platiblastin Synonym
- Platistin Synonym
- Platinoxan Synonym
- CPDC Synonym
- Cismaplat Synonym
- Citoplatino Synonym
- Rand Synonym
- Platinex Synonym
- Platinol AQ Synonym
- SPI 077 (complex) Synonym
- SPI 077B103 Synonym
- Cisplatino Synonym
- Lipoplatin Synonym
- Randa Synonym
- Fauldiscipla Synonym
- IA-call Synonym
- CP Ethypharm Synonym
- LiPlaCis Synonym
- Cisplatine Mylan Synonym
- Kemoplat Synonym
- Maruko Synonym
- cis-Diaminedichloridoplatinum(II) Synonym
- cis-Diammineplatinum(II) Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 300.05 g/mol | CAS Common Chemistry |
| 300.046 g/mol | RDKit | |
| 304.078 g/mol | chempirical lib | |
| Canonical SMILES | [Cl-][Pt+2]([Cl-])([NH3])[NH3] | CAS Common Chemistry |
| Density | 4 x 10-6 g/cm3 | CAS Common Chemistry |
| InChI | InChI=1S/2ClH.2H3N.Pt/h2*1H;2*1H3;/q;;;;+2/p-2 | CAS Common Chemistry |
| InChI Key | InChIKey=LXZZYRPGZAFOLE-UHFFFAOYSA-L | CAS Common Chemistry |
| Melting Point | 270 °C (decomp) | CAS Common Chemistry |
| Name | Cisplatin | CAS Common Chemistry |
| Heavy Atom Count | 5 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 70.0 Ų | RDKit |
| LogP | -5.670500000000001 | RDKit |
| -5.6705 | RDKit | |
| Molar Refractivity | 10.0442 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 298.955594652 g/mol | RDKit |
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
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MW = 300.05 g/mol. Edit any field — others recompute live.
