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

  • 2-{4-[(Benzyloxy)carbonyl]-6-methylmorpholin-2-yl}acetic acid
  • 2-{[(Benzyloxy)carbonyl][(furan-2-yl)methyl]amino}acetic acid
  • 2-({[(9H-fluoren-9-yl)methoxy]carbonyl}[(furan-2-yl)methyl]amino)acetic acid
  • rac-methyl (1R,3R,4S)-6-oxo-2-azabicyclo[2.2.1]heptane-3-carboxylate
  • 2-[(Benzyloxy)carbonyl]-3-methyl-1,2,3,4-tetrahydroisoquinoline-6-carboxylic acid
  • rac-tert-butyl (1R,2R,3S,4S)-3-aminobicyclo[2.2.1]hept-5-ene-2-carboxylate
  • 3-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)ethyl]-1H-indole-5-carboxylic acid
  • (1S,4S)-5-[(benzyloxy)carbonyl]-2-oxa-5-azabicyclo[2.2.1]heptane-1-carboxylic acid
  • 4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)pyrimidine-5-carboxylic acid
  • 2-[4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-5-methyl-1H-pyrazol-1-yl]acetic acid
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