Phenindamine hydrogen tartrate supplier

Name
phenindamine tartrate
EINECS 209-320-7
CAS No. 569-59-5
Density
Solubility
Melting Point 160°
Formula C₁₉H₁₉N•C₄H₆O₆
Boiling Point 416.5 °C at 760 mmHg
Molecular Weight 411.45
Flash Point 183 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms phenindamine tartrate
PSA 118.30000
LogP 1.73650

Phenindamine hydrogen tartrate Specification

The Phenindamine hydrogen tartrate with CAS registry number of 569-59-5 is also known as 1H-Indeno(2,1-c)pyridine, 2,3,4,9-tetrahydro-2-methyl-9-phenyl-, tartrate (1:1). The IUPAC name is 2,3-Dihydroxybutanedioic acid;2-methyl-9-phenyl-1,3,4,9-tetrahydroindeno[2,1-c]pyridine. Its EINECS registry number is 209-320-7. In addition, the formula is C₁₉H₁₉N•C₄H₆O₆ and the molecular weight is 411.45.

Physical properties about Phenindamine hydrogen tartrate are: (1)ACD/LogP: 3.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.76; (4)ACD/LogD (pH 7.4): 2.38; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 20.7; (7)ACD/KOC (pH 5.5): 3.49; (8)ACD/KOC (pH 7.4): 147.17; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 3.24Å²; (13)Flash Point: 183 °C; (14)Enthalpy of Vaporization: 66.98 kJ/mol; (15)Boiling Point: 416.5 °C at 760 mmHg; (16)Vapour Pressure: 3.8E-07 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. SMILES: O=C(O)[C@H](O)[C@@H](O)C(=O)O.c41c(\C3=C(/C1c2ccccc2)CN(CC3)C)cccc4
2. InChI: InChI=1/C19H19N.C4H6O6/c1-20-12-11-16-15-9-5-6-10-17(15)19(18(16)13-20)14-7-3-2-4-8-14;5-1(3(7)8)2(6)4(9)10/h2-10,19H,11-13H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)/t;1-,2-/m.1/s1
3. InChIKey: WFXURHIXPXVPGM-LREBCSMRBF

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
guinea pig	LD50	intravenous	24500ug/kg (24.5mg/kg)		Archives Internationales de Pharmacodynamie et de Therapie. Vol. 113, Pg. 313, 1958.
mouse	LD50	intraperitoneal	88mg/kg (88mg/kg)	CARDIAC: OTHER CHANGES	Journal of Pharmacology and Experimental Therapeutics. Vol. 105, Pg. 291, 1952.
mouse	LD50	intravenous	18mg/kg (18mg/kg)		U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#03034,
mouse	LD50	oral	265mg/kg (265mg/kg)		Journal of Pharmacology and Experimental Therapeutics. Vol. 105, Pg. 291, 1952.
rabbit	LD50	oral	577mg/kg (577mg/kg)		"Handbook of Analytical Toxicology," Sunshine, I., ed., Cleveland, OH, Chemical Rubber Co., 1969Vol. -, Pg. 91, 1969.
rat	LD50	oral	280mg/kg (280mg/kg)		"Handbook of Analytical Toxicology," Sunshine, I., ed., Cleveland, OH, Chemical Rubber Co., 1969Vol. -, Pg. 91, 1969.
rat	LDLo	subcutaneous	200mg/kg (200mg/kg)	BEHAVIORAL: TREMOR BEHAVIORAL: EXCITEMENT	Comptes Rendus des Seances de la Societe de Biologie et de Ses Filiales. Vol. 144, Pg. 887, 1950.

Product Name

phenindamine tartrate

Phenindamine hydrogen tartrate Specification

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