DC Chemicals Limited
China
Product Name: Esmolol
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Purity: 98.0%
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Contact: Tony Cao

81147-92-4

81147-92-4 structure

81147-92-4 structure

Name: Esmolol
Chemical Name: Esmolol
CAS Number: 81147-92-4
Molecular Formula: C₁₆H₂₅NO₄
Molecular Weight: 295.374
Catalog: API Circulatory system medication Antiarrhythmic drug
Create Date: 2018-07-01 21:30:12
Modify Date: 2024-01-02 12:28:21

Name	Esmolol
Synonyms	methyl 3-(4-{2-hydroxy-3-[(1-methylethyl)amino]propoxy}phenyl)propanoate methyl 4-[2-hydroxy-3-[(1-methylethyl)amino]-propoxy]benzenepropanoate 5-Isothiazolecarboxylic acid,3-(2-methyl-4-thiazolyl)-,methyl ester (±)-Methyl 3-[4-[2-Hydroxy-3-(isopropylamino)propoxy]phenyl]propionate Esmolol methyl 3-<4-(2-methylthiazolyl)>isothiazole-5-carboxylate Benzenepropanoic acid, 4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]-, methyl ester Methyl 3-{4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl}propanoate methyl 3-[4-({2-hydroxy-3-[(1-methylethyl)amino]propyl}oxy)phenyl]propanoate Methyl p-[2-Hydroxy-3-(isopropylamino)propoxy]hydrocinnamate methyl 3-{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}propanoate UNII:MDY902UXSR MFCD00864566 methyl 3-<4-<2-hydroxy-3-(isopropylamino)propoxy>phenyl>propionate 4-[2-Hydroxy-3-[(1-methylethyl)amino]propoxy]benzenepropanoic Acid Methyl Ester

Density	1.1±0.1 g/cm3
Boiling Point	430.2±40.0 °C at 760 mmHg
Melting Point	48-50ºC
Molecular Formula	C₁₆H₂₅NO₄
Molecular Weight	295.374
Flash Point	214.0±27.3 °C
Exact Mass	295.178345
PSA	67.79000
LogP	1.91
Vapour Pressure	0.0±1.1 mmHg at 25°C
Index of Refraction	1.512
Water Solubility	Slightly soluble

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DA8345500

CHEMICAL NAME :: Benzenepropanoic acid, 4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-, methyl ester

CAS REGISTRY NUMBER :: 81147-92-4

LAST UPDATED :: 199612

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C16-H25-N-O4

MOLECULAR WEIGHT :: 295.42

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Intravenous

DOSE :: 1200 ug/kg

SEX/DURATION :: female 15 week(s) after conception

TOXIC EFFECTS :: Reproductive - Effects on Embryo or Fetus - other effects to embryo Reproductive - Specific Developmental Abnormalities - cardiovascular (circulatory) system

REFERENCE :: ANESAV Anesthesiology. (Lippincott/Harper, Journal Fulfillment Dept., 2350 Virginia Ave., Hagerstown, MD 21740) V.1- 1940- Volume(issue)/page/year: 71,718,1989

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Intravenous

DOSE :: 3 mg/kg

SEX/DURATION :: female 15 week(s) after conception

TOXIC EFFECTS :: Reproductive - Specific Developmental Abnormalities - blood and lymphatic systems (including spleen and marrow)

REFERENCE :: ANESAV Anesthesiology. (Lippincott/Harper, Journal Fulfillment Dept., 2350 Virginia Ave., Hagerstown, MD 21740) V.1- 1940- Volume(issue)/page/year: 71,718,1989

501-97-3 structure

501-97-3

~%

81147-92-4 structure

81147-92-4

Literature: Journal of Medicinal Chemistry, , vol. 25, # 12 p. 1408 - 1412

5597-50-2 structure

5597-50-2

~%

81147-92-4 structure

81147-92-4

Literature: Journal of Medicinal Chemistry, , vol. 25, # 12 p. 1408 - 1412

81147-94-6 structure

81147-94-6

75-31-0 structure

75-31-0

~%

81147-92-4 structure

81147-92-4

Literature: Journal of Medicinal Chemistry, , vol. 25, # 12 p. 1408 - 1412

Precursor 4
501-97-3 5597-50-2 81147-94-6 75-31-0
DownStream 0