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55-31-2

Basic Information
CAS No.: 55-31-2
Name: L-Epinephrine hydrochloride
Molecular Structure:
Molecular Structure of 55-31-2 (L-Epinephrine hydrochloride)
Formula: C9H14ClNO3
Molecular Weight: 219.69
Synonyms: 1,2-Benzenediol,4-[(1R)-1-hydroxy-2-(methylamino)ethyl]-, hydrochloride (9CI);1,2-Benzenediol,4-[1-hydroxy-2-(methylamino)ethyl]-, hydrochloride, (R)-;Benzyl alcohol,3,4-dihydroxy-a-[(methylamino)methyl]-,hydrochloride, (-)- (8CI);(-)-Adrenaline hydrochloride;(-)-Epinephrinehydrochloride;Adrenalin chloride;Adrenalin hydrochloride;Adrenalinechlorhydrate;Adrenaline chloride;Adrenaline hydrochloride;Epinephrinechloride;Epinephrine hydrochloride;Gelatin-Epinephrine;Glaucon;SupranephrinSolution;Suprarenin hydrochloride;Tonogen;l-Adrenaline chloride;l-Adrenalinehydrochloride;l-Epinephrine chloride;l-Methylaminoethanolcatechol hydrochloride;
EINECS: 200-230-3
Density:
Melting Point: 157 °C
Boiling Point: 413.1 °C at 760 mmHg
Flash Point: 207.9 °C
Solubility:
Appearance: crystals
Hazard Symbols:
Risk Codes: R24/25; R36/37/38
Safety:
Transport Information:
PSA: 72.72000
LogP: 1.54350
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Chemistry

IUPAC Name: 4-[(1R)-1-Hydroxy-2-(methylamino)ethyl]benzene-1,2-diol hydrochloride
Synonyms of L-Epinephrine hydrochloride (CAS NO.55-31-2): (-)-3,4-Dihydroxy-alpha-((methylamino)methyl)benzyl alcohol hydrochloride ; 4-(1-Hydroxy-2-(methylamino)ethyl)-1,2-benzenediol hydrochloride ; Adrenalin chloride ; Epinephrine chloride ; l-Methylaminoethanolcathechol hydrochloride
CAS NO: 55-31-2
Molecular Formula: C9H14ClNO3
Molecular Weight: 219.67
Molecular Structure:
EINECS: 200-230-3
H bond acceptors: 4
H bond donors: 4
Freely Rotating Bonds: 6
Polar Surface Area: 30.93 Å2
Flash Point: 207.9 °C
Melting Poin: 157°C
Boiling Point: 413.1 °C at 760 mmHg 
Enthalpy of Vaporization: 70.21 kJ/mol 
Vapour Pressure: 1.45E-07 mmHg at 25°C 
Appearance: crystals
SMILES: Cl.Oc1ccc(cc1O)[C@@H](O)CNC
InChI: InChI=1/C9H13NO3.ClH/c1-10-5-9(13)6-2-3-7(11)8(12)4-6;/h2-4,9-13H,5H2,1H3;1H/t9-;/m0./s1
InChIKey: ATADHKWKHYVBTJ-FVGYRXGTBN
Std. InChI: InChI=1S/C9H13NO3.ClH/c1-10-5-9(13)6-2-3-7(11)8(12)4-6;/h2-4,9-13H,5H2,1H3;1H/t9-;/m0./s1
Std. InChIKey: ATADHKWKHYVBTJ-FVGYRXGTSA-N

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LDLo intravenous 200ug/kg (0.2mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 13, Pg. 51, 1963.
guinea pig LDLo subcutaneous 2mg/kg (2mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 13, Pg. 51, 1963.
mouse LD50 intraperitoneal 4664ug/kg (4.664mg/kg) VASCULAR: BP LOWERING NOT CHARACTERIZED IN AUTONOMIC SECTION Journal of Pharmacology and Experimental Therapeutics. Vol. 90, Pg. 110, 1947.
mouse LD50 intravenous 140ug/kg (0.14mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

LUNGS, THORAX, OR RESPIRATION: DYSPNEA
European Journal of Pharmacology. Vol. 9, Pg. 289, 1970.
mouse LD50 subcutaneous 1980ug/kg (1.98mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: EXCITEMENT
Journal of Pharmacology and Experimental Therapeutics. Vol. 87, Pg. 214, 1946.
mouse LDLo oral 50mg/kg (50mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 13, Pg. 51, 1963.
rat LD50 intraduodenal 35mg/kg (35mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 180, Pg. 155, 1969.
rat LD50 oral 24mg/kg (24mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 180, Pg. 155, 1969.
rat LD50 subcutaneous 5mg/kg (5mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 180, Pg. 155, 1969.
rat LDLo intravenous 50ug/kg (0.05mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION

GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS
Journal of Pharmacology and Experimental Therapeutics. Vol. 24, Pg. 101, 1925.

Consensus Reports

Reported in NTP Carcinogenesis Studies (Inhalation); Inadequate Study: rat, mouse NTPTR*    National Toxicology Program Technical Report Series. (Research Triangle Park, NC 27709) No. NTP-TR-380 ,1990. .

Safety Profile

Poison by ingestion, intravenous, subcutaneous, and intraperitoneal routes. An experimental teratogen. Other experimental reproductive effects. When heated to decomposition it emits very toxic fumes of Cl and NOx. See also VASOTONIN and other adrenalin compounds.
Safety Information aboout L-Epinephrine hydrochloride (CAS NO.55-31-2):
RIDADR: 3249
HazardClass: 6.1(a)
PackingGroup: II

Specification

Health Hazard of L-Epinephrine hydrochloride (CAS NO.55-31-2): Adverse reactions include restlessness; anxiety; headache; tremor; weakness; dizziness; pallor; respiratory difficulties; palpitation; nausea and vomiting.