CAS No.95734-82-0,Nedaplatin Suppliers

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Basic Information

Molecular Structure:
CAS No.:	95734-82-0
Name:	Nedaplatin
Article Data:	2

Formula:	C₂H₈N₂O₃Pt
Molecular Weight:	303.177
Synonyms:	Platinum,diammine[hydroxyacetato(2-)-O1,O2]-,(SP-4-3)-;Acetic acid, hydroxy-, platinum complex;254S;Aqupla;NSC 375101;
Boiling Point:	265.6oC at 760 mmHg
Flash Point:	128.7oC
Appearance:	Straw yellow powder
PSA:	42.01000
LogP:	0.12010

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Specification

The Nedaplatin is an organic compound with the formula C₂H₈N₂O₃Pt. The IUPAC name of this chemical is azanide; 2-hydroxyacetic acid; platinum(2+). With the CAS registry number 95734-82-0, it is also named as (Glycolato-O,O')diammineplatinum(II). The product's category is Anticancer Platinum Agent. Besides, it is a platinum compound which is used for cancer chemotherapy.

Physical properties about Nedaplatin are: (1)ACD/LogP: -1.05; (2)ACD/LogD (pH 5.5): -3.22; (3)ACD/LogD (pH 7.4): -4.63; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 35.53 Å²; (12)Flash Point: 128.7 °C; (13)Enthalpy of Vaporization: 58.47 kJ/mol; (14)Boiling Point: 265.6 °C at 760 mmHg; (15)Vapour Pressure: 0.00125 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [Pt+2].O=C(O)CO.[NH2-].[NH2-]
(2)InChI: InChI=1/C2H4O3.2H2N.Pt/c3-1-2(4)5;;;/h3H,1H2,(H,4,5);2*1H2;/q;2*-1;+2
(3)InChIKey: KLNFSAOEKUDMFA-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C2H4O3.2H2N.Pt/c3-1-2(4)5;;;/h3H,1H2,(H,4,5);2*1H2;/q;2*-1;+2
(5)Std. InChIKey: KLNFSAOEKUDMFA-UHFFFAOYSA-N

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
dog	LDLo	intravenous	4mg/kg (4mg/kg)		Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 26, Pg. 740, 1995.
mouse	LD50	intravenous	44100ug/kg (44.1mg/kg)		Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 26, Pg. 740, 1995.
rat	LDLo	intravenous	20mg/kg (20mg/kg)	KIDNEY, URETER, AND BLADDER: "CHANGES IN TUBULES (INCLUDING ACUTE RENAL FAILURE, ACUTE TUBULAR NECROSIS)" KIDNEY, URETER, AND BLADDER: OTHER CHANGES IN URINE COMPOSITION	Kiso to Rinsho. Clinical Report. Vol. 29, Pg. 3585, 1995.