CAS No.88069-67-4,PILSICAINIDE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	88069-67-4
Name:	PILSICAINIDE
Article Data:	1

Formula:	C₁₇H₂₄N₂O
Molecular Weight:	272.39
Synonyms:	Pilsicainide;Pilzicainide;N-(2,6-Dimethylphenyl)-2-(tetrahydro-1H-pyrrolizin-7a(5H)-yl)acetamide;
Density:	1.11 g/cm³
Boiling Point:	416.9 °C at 760 mmHg
Flash Point:	205.9 °C
Hazard Symbols:	Xn
Risk Codes:	22
PSA:	32.34000
LogP:	3.27130

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Specification

The CAS register number of Pilsicainide is 88069-67-4. It also can be called as N-(2,6-Dimethylphenyl)-2-(tetrahydro-1H-pyrrolizin-7a(5H)-yl)acetamide and the IUPAC name about this chemical is N-(2,6-dimethylphenyl)-2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)acetamide. The molecular formula about this chemical is C₁₇H₂₄N₂O and the molecular weight is 272.39. Classification code about this chemical are Anti-Arrhythmia Agents, Cardiovascular Agents, Drug / Therapeutic Agent, Membrane Transport Modulators and Sodium Channel Blockers. This chemical is an antiarrhythmic agent.

Physical properties about Pilsicainide are: (1)ACD/LogP: 3.05; (2)ACD/LogD (pH 5.5): -0.04; (3)ACD/LogD (pH 7.4): 0.53; (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): 3.31; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 23.55 Å²; (12)Index of Refraction: 1.581; (13)Molar Refractivity: 81.24 cm³; (14)Molar Volume: 243.5 cm³; (15)Polarizability: 32.2x10^-24cm³; (16)Surface Tension: 47 dyne/cm; (17)Enthalpy of Vaporization: 67.02 kJ/mol; (18)Boiling Point: 416.9 °C at 760 mmHg; (19)Vapour Pressure: 3.7E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Nc1c(cccc1C)C)CC23N(CCC2)CCC3
(2)InChI: InChI=1/C17H24N2O/c1-13-6-3-7-14(2)16(13)18-15(20)12-17-8-4-10-19(17)11-5-9-17/h3,6-7H,4-5,8-12H2,1-2H3,(H,18,20)
(3)InChIKey: BCQTVJKBTWGHCX-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C17H24N2O/c1-13-6-3-7-14(2)16(13)18-15(20)12-17-8-4-10-19(17)11-5-9-17/h3,6-7H,4-5,8-12H2,1-2H3,(H,18,20)
(5)Std. InChIKey: BCQTVJKBTWGHCX-UHFFFAOYSA-N

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Source
dog	LD50	oral	53mg/kg (53mg/kg)	Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 22, Pg. 769, 1991.
mouse	LD50	intraperitoneal	85mg/kg (85mg/kg)	Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 22, Pg. 769, 1991.
mouse	LD50	intravenous	17mg/kg (17mg/kg)	Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 22, Pg. 769, 1991.
mouse	LD50	oral	175mg/kg (175mg/kg)	Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 22, Pg. 769, 1991.
rat	LD50	intraperitoneal	105mg/kg (105mg/kg)	Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 22, Pg. 769, 1991.
rat	LD50	intravenous	18mg/kg (18mg/kg)	Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 22, Pg. 769, 1991.
rat	LD50	oral	255mg/kg (255mg/kg)	Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 22, Pg. 769, 1991.