Benzo[a]heptalen-9(5H)-one,6,7-dihydro-7-[[(2-hydroxyphenyl)methyl]methylamino]-1,2,3,10-tetramethoxy-,(7S)-

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Names

[ Name ]:
Benzo[a]heptalen-9(5H)-one,6,7-dihydro-7-[[(2-hydroxyphenyl)methyl]methylamino]-1,2,3,10-tetramethoxy-,(7S)-

[Synonym ]:
(7S)-6,7-Dihydro-7-[[(2-hydroxyphenyl)methyl]methylamino]-1,2,3,10-tetramethoxybenzo[a]heptalen-9(5H)-one
(S)-1,2,3,10-tetramethoxy-7-(methyl-salicyl-amino)-6,7-dihydro-5H-benzo[a]heptalen-9-one
(S)-6,7-Dihydro-7-[[(2-hydroxyphenyl)methyl]methylamino]-1,2,3,10-tetramethoxybenzo[a]heptalen-9(5H)-one

Chemical & Physical Properties

[ Density]:
1.27g/cm3

[ Boiling Point ]:
720.4ºC at 760 mmHg

[ Molecular Formula ]:
C₂₈H₃₁NO₆

[ Molecular Weight ]:
477.54900

[ Flash Point ]:
389.5ºC

[ Exact Mass ]:
477.21500

[ PSA ]:
77.46000

[ LogP ]:
4.57310

[ Vapour Pressure ]:
1.9E-21mmHg at 25°C

[ Index of Refraction ]:
1.626

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DF9485000

CHEMICAL NAME :: Benzo(a)heptalen-9(5H)-one, 6,7-dihydro-7-(((2-hydroxyphenyl)methyl)methylamino)- 1,2,3,10-tetramethoxy-, (S)-

CAS REGISTRY NUMBER :: 16892-03-8

BEILSTEIN REFERENCE NO. :: 2957282

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C28-H31-N-O6

MOLECULAR WEIGHT :: 477.60

WISWESSER LINE NOTATION :: L B677 MV&T&J CO1 DO1 EO1 JN1&1R BQ& NO1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intramuscular

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 141 mg/kg

TOXIC EFFECTS :: Nutritional and Gross Metabolic - weight loss or decreased weight gain

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 24,257,1981