Product Name: Carboxyphthalato-1,2-diaminocyclohexaneplatinum (CAS NO.65296-81-3)
Molecular Formula: C15H18N2O6Pt
Molecular Weight: 517.3972g/mol
Mol File: 65296-81-3.mol
Boiling point: 505.5 °C at 760 mmHg
Flash Point: 273.6 °C
Enthalpy of Vaporization: 81.63 kJ/mol
Vapour Pressure: 4.85E-11 mmHg at 25°C
H-Bond Donor: 5
H-Bond Acceptor: 8
Structure Descriptors of Carboxyphthalato-1,2-diaminocyclohexaneplatinum (CAS NO.65296-81-3):
IUPAC Name: (2-Azanidylcyclohexyl)azanide; benzene-1,2,4-tricarboxylic acid;platinum(2+)
Canonical SMILES: C1CCC(C(C1)[NH-])[NH-].C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)O.[Pt+2]
InChI: InChI=1S/C9H6O6.C6H12N2.Pt/c10-7(11)4-1-2-5(8(12)13)6(3-4)9(14)15;7-5-3-1-2-4-6(5)8;/h1-3H,(H,10,11)(H,12,13)(H,14,15);5-8H,1-4H2;/q;-2;+2
InChIKey: IDNIKXCEUZXOCR-UHFFFAOYSA-N
1. | ivn-rat LD50:84 mg/kg | JJIND8 JNCI, Journal of the National Cancer Institute. 67 (1981),201. | ||
2. | ipr-mus LD50:46,100 µg/kg | NCISP* National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program, Bethesda, MD 20205 JAN86 . | ||
3. | ivn-mus LD50:40,130 µg/kg | NCISP* National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program, Bethesda, MD 20205 JAN86 . |
Poison by intravenous and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NOx. See also PLATINUM COMPOUNDS.
Carboxyphthalato-1,2-diaminocyclohexaneplatinum , its CAS NO. is 65296-81-3, the synonyms are 4-Carboxyphthalato(1,2-diaminocyclohexane)platinum (II) ; Daccp ; JM 82 ; NSC 271674 ; Platinum(II), (cyclohexane-1,2-diammine)(4-carboxyphthlato)- ; TMA ; (SP-4-3)-Hydrogen (1,2,4-benzenetricarboxylato(3-)-O(1),O(2))(1,2-cyclohexanediamine-N,N') platinate(1-) ; Platinate (1-), (1,2,4-benzenetricarboxylato(3-)-O(sup 1),O(sup 2))(1,2-cyclohexanediamine-N,N')-, hydrogen, (SP-4-3)- .
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