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

  • 3-(((1-Isopropylcyclopropyl)methyl)amino)thietane 1,1-dioxide
  • Methyl 4-(1-fluorocyclobutyl)benzoate
  • 5-(7-Aminoheptylamino)-2-(2,6-dioxo-3-piperidyl)isoindoline-1,3-dione
  • 3-(Trifluoromethyl)-2-oxabicyclo[2.2.2]octane-3-carboxylic acid
  • 2-chloro-5-cyclopropyl-1H-Pyrrolo[2,3-b]pyridine
  • 4-[4-(2-methoxyphenyl)piperazin-1-yl]-6-(1H-pyrazol-1-yl)pyrimidine
  • 4-chloro-N-(2,2-dimethyl-1,3-dioxan-5-yl)nicotinamide
  • 1-(adamantan-1-ylmethyl)-4-iodo-1H-pyrazole
  • 4-[2-(Dimethylamino)ethoxy]-2-methylaniline hydrochloride
  • 2-(1,4-Dimethyl-1H-imidazol-5-yl)-5-nitrophenol
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