Naphazoline nitrate supplier

Name
Naphazoline nitrate
EINECS 225-915-4
CAS No. 5144-52-5
Density
Solubility
Melting Point 167-170 °C
Formula C₁₄H₁₄N₂^.HNO₃
Boiling Point 440.5 °C at 760 mmHg
Molecular Weight 273.32
Flash Point 220.2 °C
Transport Information
Appearance COA
Safety 22-36/37
Risk Codes 22
Molecular Structure
Hazard Symbols Xn
Synonyms Naphthizen;Rino Naftazolina;Prizoliene N;Naphazoline nitrate (JP14);Benil;Minha;Sanorin;Clera;Privine (British);Vistalbalon;Naphthisin;Imizol;Proculin;1H-Imidazole,4,5-dihydro-2-(1-naphthalenylmethyl)-,mononitrate;Sanorin Spofa;Privine;Privin;Privine (TN);Rhinon;Naftizin;Rinazina;Naphtyzin;Privine nitrate;Prizoliene A;Imidazyl;Septobore;Naphthisen;
PSA 90.44000
LogP 2.32390

Synthetic route

: 5144-52-5
Naphazoline nitrate

: 344567-18-6
bis-(2,4-dihydroxythiobenzoyl)sulfinyl

: 2-(1-naphthylmethyl)-1-(2,4-dihydroxythiobenzoyl)-2-imidazoline

Conditions

Conditions	Yield
With pyridine In methanol for 10h; Heating;

Naphazoline nitrate Specification

The IUPAC name of Naphazoline nitrate is 2-(naphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole; nitric acid. With the CAS registry number 5144-52-5, it is also named as Imidazyl. The classification code is Drug / Therapeutic Agent. It is white solid which is stable under stable temperature and pressure. It is adrenomimetic drug which has pressor function, so it can used in the common cold, rhinitis, nasal congestion, etc. When heated to decomposition it emits toxic fumes of NO_x. Additionally, Naphazoline nitrate must be sealed in the container and placed in the cool and dry aera.

The other characteristics of this product can be summarized as: (1)ACD/LogP: 3.88; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.88; (4)ACD/LogD (pH 7.4): 1.94; (5)ACD/BCF (pH 5.5): 5.25; (6)ACD/BCF (pH 7.4): 5.94; (7)ACD/KOC (pH 5.5): 30.82; (8)ACD/KOC (pH 7.4): 34.89; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Flash Point: 220.2 °C; (13)Enthalpy of Vaporization: 67.07 kJ/mol; (14)Boiling Point: 440.5 °C at 760 mmHg; (15)Vapour Pressure: 1.52E-07 mmHg at 25°C; (16)Rotatable Bond Count: 2; (17)Exact Mass: 273.111341; (18)MonoIsotopic Mass: 273.111341; (19)Topological Polar Surface Area: 90.4; (20)Heavy Atom Count: 20; (21)Complexity: 297.

When you are using this chemical, please be cautious about it as the following:
It is harmful if swallowed, so people should not breathe dust. If you want to contact this product, you must wear suitable protective clothing and gloves.

People can use the following data to convert to the molecule structure.
1. SMILES:[O-][N+](=O)O.N\1=C(\NCC/1)Cc2cccc3c2cccc3
2. InChI:InChI=1/C14H14N2.HNO3/c1-2-7-13-11(4-1)5-3-6-12(13)10-14-15-8-9-16-14;2-1(3)4/h1-7H,8-10H2,(H,15,16);(H,2,3,4)

The following are the toxicity data which has been tested.

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Source
mouse	LD50	intraperitoneal	66mg/kg (66mg/kg)	Farmaco, Edizione Pratica. Vol. 21, Pg. 204, 1966.
mouse	LD50	intravenous	13200ug/kg (13.2mg/kg)	Farmaco, Edizione Pratica. Vol. 21, Pg. 204, 1966.
mouse	LD50	oral	265mg/kg (265mg/kg)	Farmaco, Edizione Pratica. Vol. 21, Pg. 204, 1966.
mouse	LD50	subcutaneous	170mg/kg (170mg/kg)	Drugs in Japan Vol. 6, Pg. 539, 1982.
rabbit	LD50	intravenous	800ug/kg (0.8mg/kg)	Drugs in Japan Vol. 6, Pg. 539, 1982.
rabbit	LD50	oral	50mg/kg (50mg/kg)	Drugs in Japan Vol. 6, Pg. 539, 1982.
rabbit	LD50	subcutaneous	950ug/kg (0.95mg/kg)	Drugs in Japan Vol. 6, Pg. 539, 1982.
rat	LD50	oral	1260mg/kg (1260mg/kg)	Farmaco, Edizione Pratica. Vol. 21, Pg. 204, 1966.
rat	LD50	subcutaneous	385mg/kg (385mg/kg)	Drugs in Japan Vol. 6, Pg. 539, 1982.

Product Name

Naphazoline nitrate

Synthetic route

Naphazoline nitrate Specification

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