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1239-45-8

Basic Information
CAS No.: 1239-45-8
Name: Phenanthridinium,3,8-diamino-5-ethyl-6-phenyl-, bromide (1:1)
Article Data: 9
Cas Database
Molecular Structure:
Molecular Structure of 1239-45-8 (Phenanthridinium,3,8-diamino-5-ethyl-6-phenyl-, bromide (1:1))
Formula: C21H20BrN3
Molecular Weight: 394.314
Synonyms: 3,8-Diamino-5-ethyl-6-phenylphenanthridiniumbromide (6CI);Phenanthridinium, 3,8-diamino-5-ethyl-6-phenyl-, bromide(8CI,9CI);2,7-Diamino-10-ethyl-9-phenylphenanthridinium bromide;2,7-Diamino-9-phenyl-10-ethylphenanthridinium bromide;2,7-Diamino-9-phenylphenanthridine ethobromide;Dromilac;Homidium bromide;
EINECS: 214-984-6
Density: g/cm3
Melting Point: 260-262 °C (dec.)(lit.)
Boiling Point: N/A
Flash Point: >100°C
Solubility: 40 g/L (25 °C) in water
Appearance: Purple/maroon crystalline powder
Hazard Symbols: ToxicT, VeryT+
Risk Codes: 23-68-36/37/38-26-21/22-22
Safety: 36/37-45-36/37/39-28A-26-22-28
Transport Information: UN 2811 6.1/PG 1
PSA: 55.92000
LogP: 2.29820
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Chemistry

Molecular Structure:

Molecular Formula: C21H20BrN3
Molecular Weight: 394.3076
IUPAC Name: 5-Ethyl-6-phenylphenanthridin-5-ium-3,8-diamine bromide
Synonyms of Ethidium bromide (CAS NO.1239-45-8): 2,7-Diamino-10-ethyl-9-phenylphenanthridinium bromide  2,7-Diamino-9-phenyl-10-ethylphenanthridinium bromide ; 2,7-Diamino-9-phenylphenanthridine ethobromide ; 3,8-Diamino-5-ethyl-6-phenylphenanthridinium bromide ; AI3-62997 ; Bromure d'homidium ; Bromure d'homidium [INN-French] ; Bromuro de homidio ; Bromuro de homidio [INN-Spanish] ; CCRIS 1017 ; Dromilac ; EINECS 214-984-6 ; Ethydium bromide ; HSDB 7297 ; Homidii bromidum ; Homidii bromidum [INN-Latin] ; Homidium bromide ; NSC 268986 ; RD 1572 ; UNII-059NUO2Z1L ; 3,8-Diamino-1-ethyl-6-phenylphenantridinium bromide ; 3,8-Diamino-5-ethyl-6-phenylphenanthridinium bromide  ; Phenanthridinium, 3,8-diamino-5-ethyl-6-phenyl-, bromide
CAS NO: 1239-45-8
Classification Code: Drug / Therapeutic Agent ; Mutation data ; Tumor data
Melting point: 260-262 °C 
H bond acceptors: 3
H bond donors: 4
Freely Rotating Bonds: 4
Polar Surface Area: 10.36 Å2 
Water solubility: 40 g/L (25 ºC)

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 110mg/kg (110mg/kg)   Annals of Tropical Medicine and Parasitology. Vol. 46, Pg. 285, 1952.
mouse LDLo intraperitoneal 20mg/kg (20mg/kg)   Cancer Research. Vol. 34, Pg. 2699, 1974.

Consensus Reports

EPA Genetic Toxicology Program.

Safety Profile

Hazard Codes of Ethidium bromide (CAS NO.1239-45-8): ToxicT,VeryT+
Risk Statements: 23-68-36/37/38-26-21/22 
R23: Toxic by inhalation. 
R68: Possible risk of irreversible effects. 
R36/37/38: Irritating to eyes, respiratory system and skin. 
R26: Very toxic by inhalation. 
R21/22: Harmful in contact with skin and if swallowed.
Safety Statements: 45-36/37/39-26-22-28 
S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) 
S36/37/39: Wear suitable protective clothing, gloves and eye/face protection. 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S22: Do not breathe dust. 
S28: After contact with skin, wash immediately with plenty of soap-suds.
RIDADR: UN 2811 6.1/PG 1
WGK Germany :3
RTECS: SF7950000
F: 8-9
HazardClass: 6.1
PackingGroup: I
HS Code: 29339990
Poison by intraperitoneal and subcutaneous routes. Human mutation data reported. When heated to decomposition it emits very toxic fumes of NOx and Br. See also BROMIDES.

Specification

 Ethidium bromide (CAS NO.1239-45-8) is a purple/maroon crystalline powder and it is stable. It is partially soluble in cold water. It should keep in a cool, well-ventilated place.