12-deoxyphorbol 13-isobutyrate

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Names

[ Name ]:
12-deoxyphorbol 13-isobutyrate

[Synonym ]:
12-Desoxyphorbol 13-isobutyrate
12-deoxyphorbol-13-isobutyrate
12-deoxyphorbol-13-(2-methylpropionate)
Propanoic acid,2-methyl-,(1ar,1bs,4ar,7as,7br,8R,9as)-1,1A,1B4,4A,5,7A,8,9-decahydro-4A,7B-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-9ah-cyclopropa(3,4)benz(1,2-E)azulen-9A-yl ester

Chemical & Physical Properties

[ Density]:
1.26g/cm3

[ Boiling Point ]:
564.9ºC at 760mmHg

[ Molecular Formula ]:
C₂₄H₃₄O₆

[ Molecular Weight ]:
418.52300

[ Flash Point ]:
188.6ºC

[ Exact Mass ]:
418.23600

[ PSA ]:
104.06000

[ LogP ]:
2.02210

[ Vapour Pressure ]:
4.09E-15mmHg at 25°C

[ Index of Refraction ]:
1.586

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: GZ0668200

CHEMICAL NAME :: 5H-Cyclopropa(3,4)benz(1,2-e)azulen-5-one, 1,1a-alpha,1b-beta,4,4a,7a-alpha,7b,8,9,9a- decahydro-4a-beta,7b-alpha,9a-alpha-trihydroxy-3-(hyd roxymethyl)-1,1,6,8-a lpha- tetramethyl-, 9a-isobutyrate

CAS REGISTRY NUMBER :: 25090-74-8

LAST UPDATED :: 198609

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C24-H34-O6

MOLECULAR WEIGHT :: 418.58

WISWESSER LINE NOTATION :: L E3 B675 MV IU NUTJ BQ C1 EOVY1&1 F1 F1 J1Q LQ N1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: Open irritation test

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - mouse

REFERENCE :: ARTODN Archives of Toxicology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.32- 1974- Volume(issue)/page/year: 44,279,1980