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Name |
Esmolol hydrochloride |
EINECS | 636-017-0 |
CAS No. | 81161-17-3 | Density | 1.026 g/cm3 |
PSA | 67.79000 | LogP | 2.72280 |
Solubility | slightly soluble in water | Melting Point |
48-50 °C |
Formula | C16H26ClNO4 | Boiling Point | 430.2 °C at 760 mmHg |
Molecular Weight | 331.84 | Flash Point | 214 °C |
Transport Information | N/A | Appearance | white solid |
Safety | 61 | Risk Codes | 52/53 |
Molecular Structure | Hazard Symbols | 52/53:; | |
Synonyms |
Benzenepropanoic acid, 4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]-, methyl ester, hydrochloride (9CI);Brevibloc;Esmolol hydrochloride [USAN];(+-)-Methyl p-(2-hydroxy-3-(isopropylamino)propoxy)hydrocinnamate hydrochloride;4-(2-Hydroxy-3-((1-methylethyl)amino)propoxy)benzenepropanoic acid methyl ester HCl;Benzenepropanoic acid, 4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-, methyl ester, hydrochloride, (+-)-;Brevibloc in plastic container;Esmolol HCl;Benzenepropanoic acid, 4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-, methyl ester, hydrochloride; |
Article Data | 4 |
Esmolol hydrochloride , its cas register number is 81161-17-3. The IPUAC name about this chemicals is Methyl 3-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]propanoate hydrochloride .The enthalpy of vaporization about it is 72.28 kJ/mol, vapour pressure is 3.62E-08 mmHg at 25 °C . If you want to store this chemicals , the temperature must be controlled at -20 °C. Product categories about this chemicals are Cardiovascular, Intermediates & Fine Chemicals, Pharmaceuticals.
Esmolol hydrochloride is a white solid and it is beta-adrenergic blocker used to treat certain types of tachycardia.It is harmful to aquatic organisms and it may cause long-term adverse effects in the aquatic environment. And if we use it, we need to avoid release to the environment, also we use it must refer to special instructions / safety data sheets. About this chemicals ,its RTECS number is DA8346000.
This chemicals can be described computed from structure:
1) SMILES: CC(C)NCC(COC1=CC=C(C=C1)CCC(=O)OC)O.Cl
2) InChI: InChI=1S/C16H25NO4.ClH/c1-12(2)17-10-14(18)11-21-15-7-4-13(5-8-15)6-9-16(19)20-3;/h4-5,7-8,12,14,17-18H,6,9-11H2,1-3H3;1H
The most important thing about Esmolol hydrochloride is the toxicity, following is the form:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
dog | LD50 | intravenous | 32mg/kg (32mg/kg) | BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD BEHAVIORAL: ATAXIA GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS | New Cardiovascular Drugs. Vol. 3, Pg. 99, 1985. |
man | TDLo | intravenous | 775ug/kg/14M- (0.775mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD | Drug Intelligence and Clinical Pharmacy. Vol. 22, Pg. 484, 1988. |
mouse | LD50 | intravenous | 93mg/kg (93mg/kg) | New Cardiovascular Drugs. Vol. 3, Pg. 99, 1985. | |
rabbit | LD50 | intravenous | 40mg/kg (40mg/kg) | New Cardiovascular Drugs. Vol. 3, Pg. 99, 1985. | |
rat | LD50 | intravenous | 71mg/kg (71mg/kg) | New Cardiovascular Drugs. Vol. 3, Pg. 99, 1985. |