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

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Names

[ CAS No. ]:
19977-07-2

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

Chemical & Physical Properties

[ 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

Toxicological Information

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

Related Compounds

4-(2-Methoxyphenyl)butan-1-amine hydrochloride
N-[3-(2-aminoethanesulfonamido)phenyl]acetamide hydrochloride
1-(5-(4-Fluorophenyl)oxazol-2-yl)ethanamine hydrochloride
4-(4-Chlorophenyl)butan-1-amine hydrochloride
1-Benzyl-6-methoxy-1,2,3,4-tetrahydroisoquinoline hydrochloride
(3-Phenylbutyl)amine hydrochloride
[3-Cyclopropyl-3-(3,4-dimethoxyphenyl)propyl](methyl)amine hydrochloride
2-[(4-Methoxy-3-methylphenyl)methyl]pyrrolidine hydrochloride
4-(Thiophen-2-ylmethyl)piperidine hydrochloride
2-(3,4-Dimethoxybenzenesulfonyl)ethan-1-amine hydrochloride

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