2-Butenoic acid,4,4'-(2-methyl-1,4-piperazinediyl)bis[4-oxo-, diethyl ester (9CI)

Modify Date: 2025-09-04 21:41:54

2-Butenoic acid,4,4'-(2-methyl-1,4-piperazinediyl)bis[4-oxo-, diethyl ester (9CI) structure	Common Name	2-Butenoic acid,4,4'-(2-methyl-1,4-piperazinediyl)bis[4-oxo-, diethyl ester (9CI)
	CAS Number	36680-08-7	Molecular Weight	352.38200
	Density	1.185g/cm3	Boiling Point	560.2ºC at 760mmHg
	Molecular Formula	C₁₇H₂₄N₂O₆	Melting Point	N/A
	MSDS	N/A	Flash Point	292.6ºC

Name	ethyl (E)-4-[4-[(E)-4-ethoxy-4-oxobut-2-enoyl]-3-methylpiperazin-1-yl]-4-oxobut-2-enoate
Synonym	More Synonyms

Density	1.185g/cm3
Boiling Point	560.2ºC at 760mmHg
Molecular Formula	C₁₇H₂₄N₂O₆
Molecular Weight	352.38200
Flash Point	292.6ºC
Exact Mass	352.16300
PSA	93.22000
LogP	0.16010
Index of Refraction	1.513
InChIKey	XGKXDXRFGLBGBN-CDJQDVQCSA-N
SMILES	CCOC(=O)C=CC(=O)N1CCN(C(=O)C=CC(=O)OCC)C(C)C1

CHEMICAL IDENTIFICATION

RTECS NUMBER :: EM9257250

CHEMICAL NAME :: 2-Butenoic acid, 4,4'-(2-methyl-1,4-piperazinediyl)bis(4-oxo-, diethyl ester

CAS REGISTRY NUMBER :: 36680-08-7

BEILSTEIN REFERENCE NO. :: 0575566

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C17-H24-N2-O6

MOLECULAR WEIGHT :: 352.43

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 :: 700 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: APPHAX Acta Poloniae Pharmaceutica. For English translation, see APPFAR. (Ars Polona, POB 1001, 00-680 Warsaw 1, Poland) V.1- 1937- Volume(issue)/page/year: 37,249,1980

HS Code	2933599090

HS Code	2933599090
Summary	2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

1,4-dithienoylbenzene

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