2-(4-(2-Propenyl)-1-piperazinyl)-4-propoxyquinazoline (E)-2-butenedioa te (1:1)

Modify Date: 2024-01-13 12:31:38

2-(4-(2-Propenyl)-1-piperazinyl)-4-propoxyquinazoline (E)-2-butenedioa te (1:1) structure	Common Name	2-(4-(2-Propenyl)-1-piperazinyl)-4-propoxyquinazoline (E)-2-butenedioa te (1:1)
	CAS Number	129664-00-2	Molecular Weight	428.48200
	Density	N/A	Boiling Point	475.4ºC at 760 mmHg
	Molecular Formula	C₂₂H₂₈N₄O₅	Melting Point	N/A
	MSDS	N/A	Flash Point	241.3ºC

Name	2-(4-Allyl-1-piperazinyl)-4-propoxyquinazoline (2E)-2-butenedioat e (1:1)

Boiling Point	475.4ºC at 760 mmHg
Molecular Formula	C₂₂H₂₈N₄O₅
Molecular Weight	428.48200
Flash Point	241.3ºC
Exact Mass	428.20600
PSA	116.09000
LogP	2.44130
Vapour Pressure	3.34E-09mmHg at 25°C
InChIKey	IUHFBXAGCCTZQG-WLHGVMLRSA-N
SMILES	C=CCN1CCN(c2nc(OCCC)c3ccccc3n2)CC1.O=C(O)C=CC(=O)O

CHEMICAL IDENTIFICATION

RTECS NUMBER :: VA1540000

CAS REGISTRY NUMBER :: 129664-00-2

LAST UPDATED :: 199212

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C18-H24-N4-O.C4-H4-O4

MOLECULAR WEIGHT :: 428.54

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 429 mg/kg

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

REFERENCE :: CPBTAL Chemical and Pharmaceutical Bulletin. (Japan Pub. Trading Co., USA, 1255 Howard St., San Francisco, CA 94103) V.6- 1958- Volume(issue)/page/year: 38,1286,1990

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