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63919-17-5

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Basic Information
CAS No.: 63919-17-5
Name: platinum(2+) azanide benzylpropanedioic acid (1:2:1)
Article Data: 2
Molecular Structure:
Molecular Structure of 63919-17-5 (platinum(2+) azanide benzylpropanedioic acid (1:2:1))
Formula: C10H14 N2 O4 Pt
Molecular Weight: 421.35
Synonyms: Platinum,diammine[(phenylmethyl)propanedioato(2-)-O,O']-, (SP-4-2)-; Propanedioic acid,(phenylmethyl)-, platinum complex; NSC 201342; NSC 215159
Boiling Point: 378.4°C at 760 mmHg
Flash Point: 196.8°C
Hazard Symbols: A poison. TWA 0.002 mg(Pt)/m3
Safety: A poison by an unreported route. When heated to decomposition it emits toxic vapors of NOx and Pt.
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Chemistry

Molecule structure of Diammine(benzylmalonato)platinum (II) (CAS NO.63919-17-5):

IUPAC Name: Azane; 2-benzylpropanedioate; platinum(2+) 
Molecular Weight: 421.30716 g/mol
Molecular Formula: C10H14N2O4Pt 
Boiling Point: 378.4 °C at 760 mmHg
Flash Point: 196.8 °C
Enthalpy of Vaporization: 66.06 kJ/mol
Vapour Pressure: 2.12E-06 mmHg at 25 °C
H-Bond Donor: 2
H-Bond Acceptor: 6
Rotatable Bond Count: 2
Exact Mass: 421.060131
MonoIsotopic Mass: 421.060131
Topological Polar Surface Area: 82.3
Heavy Atom Count: 17
Complexity: 193
Canonical SMILES: C1=CC=C(C=C1)CC(C(=O)[O-])C(=O)[O-].N.N.[Pt+2]
InChI: InChI=1S/C10H10O4.2H3N.Pt/c11-9(12)8(10(13)14)6-7-4-2-1-3-5-7;;;/h1-5,8H,6H2,(H,11,12)(H,13,14);2*1H3;/q;;;+2/p-2
InChIKey of Diammine(benzylmalonato)platinum (II) (CAS NO.63919-17-5): FXAULVBZJYGZFE-UHFFFAOYSA-L

Toxicity Data With Reference

1.    

unr-mus LD50:150 mg/kg

     RRCRBU    Recent Results in Cancer Research. 48 (1974),12.

Safety Profile

A poison by an unreported route. When heated to decomposition it emits toxic vapors of NOx and Pt.

Standards and Recommendations

ACGIH TLV: TWA 0.002 mg(Pt)/m3

Specification

 Diammine(benzylmalonato)platinum (II) (CAS NO.63919-17-5) is also named as Platinum (II), diammine(benzylmalonato)- .