Aeroplysinin(Aeroplysinin-1)

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Names

[ CAS No. ]:
28656-91-9

[ Name ]:
Aeroplysinin(Aeroplysinin-1)

[Synonym ]:
AEROPLYSININ,APLYSINA AEROPHOBA
aeroplysinin 1
4-cyclohexadiene-1-acetonitrile,3,5-dibromo-1,6-dihydroxy-4-methoxy-(1s-tr
(1s-trans)-3,5-dibromo-1,6-dihydroxy-4-methoxy-2,4-cyclohexadiene-1-acetonit
AEROPLYSININ
Aeroplysinin I

Chemical & Physical Properties

[ Density]:
2.01g/cm3

[ Boiling Point ]:
479.6ºC at 760 mmHg

[ Molecular Formula ]:
C9H9Br2NO3

[ Molecular Weight ]:
338.98100

[ Flash Point ]:
243.8ºC

[ Exact Mass ]:
336.89500

[ PSA ]:
73.48000

[ LogP ]:
1.53738

[ Vapour Pressure ]:
3.27E-11mmHg at 25°C

[ Index of Refraction ]:
1.645

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GU4735000
CHEMICAL NAME :
2,4-Cyclohexadiene-1-acetonitrile, 3,5-dibromo-1,6-dihydroxy-4-methoxy-, (1S-trans)-
CAS REGISTRY NUMBER :
28656-91-9
LAST UPDATED :
199204
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H9-Br2-N-O3
MOLECULAR WEIGHT :
339.01

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
202 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ZNCBDA Zeitschrift fuer Naturforschung, Section C: Biosciences. (Verlag der Zeitschrift fuer Naturforschung, Postfach 2645, D-7400 Tuebingen, Fed. Rep. Ger.) V.29- 1974- Volume(issue)/page/year: 44,680,1989

Related Compounds

  • 2,5-Cyclohexadiene-1-acetamide,3,5-dibromo-1-hydroxy-4-oxo-
  • 2,4-Cyclohexadiene-1-acetonitrile, 3,5-dibromo-1,6-dihydroxy-4-methoxy-, trans-(+-)-
  • aeroplysinin
  • 2-[(1R,6S)-3,5-dibromo-1,6-dihydroxy-4-methoxycyclohexa-2,4-dien-1-yl]acetonitrile
  • 2-ethyl-1-[1-(2-morpholin-4-ium-4-ylethyl)pyrrol-2-yl]butan-1-one,chloride
  • 5-naphthalen-1-ylcyclohexane-1,3-dione