1-Piperazineethanol, 4-(m-chlorobenzyl)-alpha-(1,3-dimethyl-7-xanthiny lmethyl)-, benzoate (ester)

Modify Date: 2024-02-29 10:24:36

1-Piperazineethanol, 4-(m-chlorobenzyl)-alpha-(1,3-dimethyl-7-xanthiny lmethyl)-, benzoate (ester) structure	Common Name	1-Piperazineethanol, 4-(m-chlorobenzyl)-alpha-(1,3-dimethyl-7-xanthiny lmethyl)-, benzoate (ester)
	CAS Number	19977-07-2	Molecular Weight	551.03700
	Density	1.36g/cm3	Boiling Point	737.4ºC at 760mmHg
	Molecular Formula	C₂₈H₃₁ClN₆O₄	Melting Point	N/A
	MSDS	N/A	Flash Point	399.7ºC

Name	1-Piperazineethanol, 4-(m-chlorobenzyl)-α-(1,3-dimethyl-7-xanthiny lmethyl)-, benzoate (ester)

Density	1.36g/cm3
Boiling Point	737.4ºC at 760mmHg
Molecular Formula	C₂₈H₃₁ClN₆O₄
Molecular Weight	551.03700
Flash Point	399.7ºC
Exact Mass	550.21000
PSA	94.60000
LogP	2.00630
Vapour Pressure	1.32E-21mmHg at 25°C
Index of Refraction	1.662

CHEMICAL IDENTIFICATION

RTECS NUMBER :: TL6970000

CHEMICAL NAME :: 1-Piperazineethanol, 4-(m-chlorobenzyl)-alpha-(1,3-dimethyl-7-xanthinylmet hyl)-, benzoate (ester)

CAS REGISTRY NUMBER :: 19977-07-2

BEILSTEIN REFERENCE NO. :: 0601226

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C28-H31-Cl-N6-O4

MOLECULAR WEIGHT :: 551.10

WISWESSER LINE NOTATION :: T56 BN DN FNVNVJ F1 H1 B1YR CG&- AT6N DNTJ D2OVR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 58 mg/kg

TOXIC EFFECTS :: Behavioral - convulsions or effect on seizure threshold Behavioral - excitement

REFERENCE :: YKKZAJ Yakugaku Zasshi. Journal of Pharmacy. (Nippon Yakugakkai, 2-12-15 Shibuya, Shibuya-ku, Tokyo 150, Japan) No.1- 1881- Volume(issue)/page/year: 89,771,1969

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