CAS No.486-12-4,Triprolidine Suppliers

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Basic Information

Molecular Structure:
CAS No.:	486-12-4
Name:	Triprolidine
Article Data:	7

Formula:	C₁₉H₂₂N₂
Molecular Weight:	278.397
Synonyms:	Pyridine,2-[(1E)-1-(4-methylphenyl)-3-(1-pyrrolidinyl)-1-propenyl]- (9CI);Pyridine,2-[1-(4-methylphenyl)-3-(1-pyrrolidinyl)-1-propenyl]-, (E)-;Pyridine,2-[3-(1-pyrrolidinyl)-1-p-tolylpropenyl]-, (E)- (8CI);Triprolidin;Triprolidine;Tripyrolidine;trans-1-(2-Pyridyl)-3-pyrrolidino-1-p-tolylprop-1-ene;trans-1-(4-Methylphenyl)-1-(2-pyridyl)-3-pyrrolidinoprop-1-ene;trans-2-[3-(1-Pyrrolidinyl)-1-p-tolypropenyl]pyridine;
EINECS:	207-627-0
Density:	1.061 g/cm³
Melting Point:	59-61 °C
Boiling Point:	435.4 °C at 760 mmHg
Flash Point:	217.1 °C
Solubility:	insoluble in water
Appearance:	crystals
PSA:	16.13000
LogP:	3.85540

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Specification

The Triprolidine, with the CAS registry number 486-12-4, is also known as Pyridine, 2-[(1Z)-1-(4-methylphenyl)-3-(1-pyrrolidinyl)-1-propen-1-yl]-. Its EINECS registry number is 207-627-0. This chemical's molecular formula is C₁₉H₂₂N₂ and molecular weight is 278.39. Its IUPAC name is called 2-[(E)-1-(4-methylphenyl)-3-pyrrolidin-1-ylprop-1-enyl]pyridine. This chemical's classification codes are Anti-allergic agents; Drug / Therapeutic Agent; Histamine Agents; Histamine Antagonists; Histamine H1 antagonists; Human Data; Neurotransmitter Agents. Triprolidine is used to combat the symptoms associated with allergies and is sometimes combined with other cold medications designed to provide general relief for flu-like symptoms. What' more, it is a quick acting drug that can clear congestion and stop runny noses in 15-30 minutes. It is crystals.

Physical properties of Triprolidine: (1)ACD/LogP: 4.22; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.26; (4)ACD/LogD (pH 7.4): 2.72; (5)ACD/BCF (pH 5.5): 1.03; (6)ACD/BCF (pH 7.4): 29.87; (7)ACD/KOC (pH 5.5): 5.11; (8)ACD/KOC (pH 7.4): 147.98; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Index of Refraction: 1.587; (13)Molar Refractivity: 88.12 cm³; (14)Molar Volume: 262.1 cm³; (15)Surface Tension: 43.2 dyne/cm; (16)Density: 1.061 g/cm³; (17)Flash Point: 217.1 °C; (18)Enthalpy of Vaporization: 69.17 kJ/mol; (19)Boiling Point: 435.4 °C at 760 mmHg; (20)Vapour Pressure: 8.8E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CC=C(C=C1)C(=CCN2CCCC2)C3=CC=CC=N3
(2)Isomeric SMILES: CC1=CC=C(C=C1)/C(=C\CN2CCCC2)/C3=CC=CC=N3
(3)InChI: InChI=1S/C19H22N2/c1-16-7-9-17(10-8-16)18(19-6-2-3-12-20-19)11-15-21-13-4-5-14-21/h2-3,6-12H,4-5,13-15H2,1H3/b18-11+
(4)InChIKey: CBEQULMOCCWAQT-WOJGMQOQSA-N

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
human	TDLo	oral	143ug/kg (0.143mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: ALTERATION OF OPERANT CONDITIONING BEHAVIORAL: CHANGES IN PSYCHOPHYSIOLOGICAL TESTS	European Journal of Clinical Pharmacology. Vol. 47, Pg. 331, 1994.