Molecule structure of Dichloro(4-ethoxy-o-phenylenediammine)platinum (II) (CAS NO.72595-96-1):
IUPAC Name: Dichloroplatinum; 4-ethoxybenzene-1,2-diamine
Molecular Weight: 418.17768 g/mol
Molecular Formula: C8H12Cl2N2OPt
Boiling Point: 295 °C at 760 mmHg
Flash Point: 163.8 °C
Enthalpy of Vaporization: 53.47 kJ/mol
Vapour Pressure: 0.00157 mmHg at 25 °C
H-Bond Donor: 2
H-Bond Acceptor: 3
Rotatable Bond Count: 2
Exact Mass: 416.997442
MonoIsotopic Mass: 416.997442
Topological Polar Surface Area: 61.3
Heavy Atom Count: 14
Complexity: 121
Canonical SMILES: CCOC1=CC(=C(C=C1)N)N.Cl[Pt]Cl
InChI: InChI=1S/C8H12N2O.2ClH.Pt/c1-2-11-6-3-4-7(9)8(10)5-6;;;/h3-5H,2,9-10H2,1H3;2*1H;/q;;;+2/p-2
InChIKey of Dichloro(4-ethoxy-o-phenylenediammine)platinum (II) (CAS NO.72595-96-1): SISSYKYRBNHAMG-UHFFFAOYSA-L
1. | mmo-sat 2500 nmol/L | JMCMAR Journal of Medicinal Chemistry. 23 (1980),459. |
Mutation data reported. See also PLATINUM COMPOUNDS. When heated to decomposition it emits very toxic fumes of Cl− and NOx.
Dichloro(4-ethoxy-o-phenylenediammine)platinum (II) (CAS NO.72595-96-1) is also named as Platinum (II), dichloro(4-ethoxy-o-phenylenediammine)- .
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