(E,E)-3-(2-Methoxy-5-(1-oxo-3-phenyl-2-propenyl)phenyl)-2-butenoic aci d

Modify Date: 2025-09-17 19:25:10

(E,E)-3-(2-Methoxy-5-(1-oxo-3-phenyl-2-propenyl)phenyl)-2-butenoic aci d structure	Common Name	(E,E)-3-(2-Methoxy-5-(1-oxo-3-phenyl-2-propenyl)phenyl)-2-butenoic aci d
	CAS Number	82885-73-2	Molecular Weight	322.35500
	Density	1.197g/cm3	Boiling Point	538.4ºC at 760 mmHg
	Molecular Formula	C₂₀H₁₈O₄	Melting Point	N/A
	MSDS	N/A	Flash Point	193.5ºC

Name	(2E)-3-{2-Methoxy-5-[(2E)-3-phenyl-2-propenoyl]phenyl}-2-butenoic acid

Density	1.197g/cm3
Boiling Point	538.4ºC at 760 mmHg
Molecular Formula	C₂₀H₁₈O₄
Molecular Weight	322.35500
Flash Point	193.5ºC
Exact Mass	322.12100
PSA	63.60000
LogP	4.07920
Index of Refraction	1.619
InChIKey	OKCNUCLRBVLDQF-SHQVAAIUSA-N
SMILES	COc1ccc(C(=O)C=Cc2ccccc2)cc1C(C)=CC(=O)O

CHEMICAL IDENTIFICATION

RTECS NUMBER :: EM9252000

CHEMICAL NAME :: 2-Butenoic acid, 3-(2-methoxy-5-(1-oxo-3-phenyl-2-propenyl)phenyl)-, (E,E)-

CAS REGISTRY NUMBER :: 82885-73-2

LAST UPDATED :: 199803

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C20-H18-O4

MOLECULAR WEIGHT :: 322.38

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 550 mg/kg

TOXIC EFFECTS :: Toxic effects not yet reviewed

REFERENCE :: USXXAM United States Patent Document. (U.S. Patent Office, Box 9, Washington, DC 20231) Volume(issue)/page/year: #4421927

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