CAS No.2508-72-7,Antazoline hydrochloride Suppliers

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Basic Information

Molecular Structure:
CAS No.:	2508-72-7
Name:	Antazoline hydrochloride

Formula:	C₁₇H₁₉N₃ ^.HCl
Molecular Weight:	301.819
Synonyms:	1H-Imidazole-2-methanamine,4,5-dihydro-N-phenyl-N-(phenylmethyl)-, monohydrochloride (9CI);2-Imidazoline,2-[(N-benzylanilino)methyl]-, monohydrochloride (8CI);2-(N-Benzylanilinomethyl)-2-imidazoline hydrochloride;5512M;Antastan;Antasten;Antazoline chloride;Antihistal;Antistin;Antistina;Antistine hydrochloride;Azalone;Ben-a-hist;Dibistin;Fenazolina;Histazine;Histostab;Imidamine;Phenazoline hydrochloride;
EINECS:	219-719-8
Melting Point:	238 °C
Boiling Point:	475.5 °C at 760 mmHg
Flash Point:	241.4 °C
Solubility:	Soluble in ethanol (200 mg/ 4.0 ml-clear, colorless solution)
Appearance:	White or almost white crystalline powder
Hazard Symbols:	Xi; Xn
Risk Codes:	20/21/22-36/37/38
Safety:	26-36
PSA:	27.63000
LogP:	3.26130

Synthetic route

: 2508-72-7
antazoline hydrochloride

A: 15539-77-2
4-nitrobenzyl nitrate

B: 489-98-5
picramide

C: 95711-93-6
N,2,4,6-Tetranitro-N-(2-nitrobenzyl)-anilin

D: 95711-94-7
N,2,4,6-Tetranitro-N-(3-nitrobenzyl)-anilin

E: 95711-95-8
N,2,4,6-Tetranitro-N-(4-nitrobenzyl)-anilin

F: 555-16-8
4-nitrobenzaldehdye

Conditions

Conditions	Yield
With nitric acid Product distribution;

...Expand

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Specification

The Antazoline hydrochloride, with the CAS registry number 2508-72-7 and EINECS registry number 219-719-8, has the systematic name of N-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline hydrochloride (1:1). It is a kind of white or almost white crystalline powder, and belongs to the product category of Histamine receptor. And the molecular formula of this chemical is C₁₇H₁₉N₃ ^.HCl. What's more, it is a kind of anticholinergic drug with anesthetic effect, and often used for antianaphylaxis and antiarrhythmia.

The physical properties of Antazoline hydrochloride are as following: (1)ACD/LogP: 4.39; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.39; (4)ACD/LogD (pH 7.4): 2.43; (5)ACD/BCF (pH 5.5): 12.82; (6)ACD/BCF (pH 7.4): 14; (7)ACD/KOC (pH 5.5): 58.39; (8)ACD/KOC (pH 7.4): 63.75; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 18.84 Å²; (13)Flash Point: 241.4 °C; (14)Enthalpy of Vaporization: 73.9 kJ/mol; (15)Boiling Point: 475.5 °C at 760 mmHg; (16)Vapour Pressure: 3.31E-09 mmHg at 25°C.

You should be cautious while dealing with this chemical. It irritates eyes, respiratory system and skin, and it is also harmful by inhalation, in contact with skin and if swallowed. Therefore, you had better take the following instructions: Wear suitable protective clothing, and in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl.N\1=C(\NCC/1)CN(c2ccccc2)Cc3ccccc3
(2)InChI: InChI=1/C17H19N3.ClH/c1-3-7-15(8-4-1)13-20(14-17-18-11-12-19-17)16-9-5-2-6-10-16;/h1-10H,11-14H2,(H,18,19);1H
(3)InChIKey: SWKDMSRRIBZZAY-UHFFFAOYAV

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
dog	LD50	intravenous	30mg/kg (30mg/kg)	BEHAVIORAL: TREMOR BEHAVIORAL: IRRITABILITY GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS	Federation Proceedings, Federation of American Societies for Experimental Biology. Vol. 10, Pg. 338, 1951.
guinea pig	LD50	intravenous	17100ug/kg (17.1mg/kg)		Archives Internationales de Pharmacodynamie et de Therapie. Vol. 113, Pg. 313, 1958.