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-(3-bromo-1-methyl-1H-pyrazol-4-yl)-2-hydroxypropanoic acid
  • 2-Hydroxy-3-(3-methylpyrazin-2-yl)propanoic acid
  • 6-Amino-5-(pyridin-3-yl)-2-sulfanyl-3,4-dihydropyrimidin-4-one
  • methyl 5-{[(2-hydroxyethyl)amino]methyl}-1-methyl-1H-pyrazole-3-carboxylate
  • 2,6-diethyl-N-methylbenzene-1-sulfonamide
  • 2-(1-Ethoxycyclobutyl)ethan-1-amine hydrochloride
  • 2-[(Dimethylamino)methyl]-4-(3-sulfanylpropyl)phenol
  • 1-(3-Ethylphenyl)-3-oxocyclobutane-1-carbonitrile
  • 3-{3-[(Dimethylamino)methyl]-4-hydroxyphenyl}propanal
  • 3-Oxo-1-[3-(propan-2-yl)phenyl]cyclobutane-1-carbonitrile
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