Name: 1H-2,8a-Methanocyclopenta(a)cyclopropa(e)cyclodecen-11-one, 2,5,5a,6,9 ,10,10a,1a-octahydro-4-hydroxymethyl-1,1,7,9-tetramethyl-5,5a,6-trihyd roxy-, 5-hexadecanoate
SKU: 37394-33-5

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Basic Information

Molecular Structure:
CAS No.:	37394-33-5
Name:	1H-2,8a-Methanocyclopenta(a)cyclopropa(e)cyclodecen-11-one, 2,5,5a,6,9 ,10,10a,1a-octahydro-4-hydroxymethyl-1,1,7,9-tetramethyl-5,5a,6-trihyd roxy-, 5-hexadecanoate

Formula:	C36H58 O6
Molecular Weight:	586.94
Synonyms:	1H-2,8a-Methanocyclopenta[a]cyclopropa[e]cyclodecene,hexadecanoic acid deriv.; Ingenol 5-palmitate
Density:	1.12g/cm³
Boiling Point:	670.5°Cat760mmHg
Flash Point:	198.9°C
Safety:	Questionable carcinogen with experimental tumorigenic data. A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes.

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Chemistry

Product Name: Ingenane hexadecanoate
CAS Registry Number: 37394-33-5
Molecular Weight: 586.84212 [g/mol]
Molecular Formula: C₃₆H₅₈O₆
XLogP3-AA: 7.6
H-Bond Donor: 3
H-Bond Acceptor: 6
Surface Tension: 48.4 dyne/cm
Density: 1.12 g/cm³
Flash Point: 198.9 °C
Enthalpy of Vaporization: 112.74 kJ/mol
Boiling Point: 670.5 °C at 760 mmHg
Vapour Pressure: 7.62E-21 mmHg at 25°C
Following is the molecular structure of Ingenane hexadecanoate (CAS NO.37394-33-5) is:

Toxicity Data With Reference

1.		skin-mus 82 ng MLD		85CVA2 Oncology 1970. 5 (1970),213.
2.		skin-mus TDLo:56 mg/kg/12W-I:ETA		85CVA2 Oncology 1970. 5 (1970),213.

Safety Profile

Questionable carcinogen with experimental tumorigenic data. A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes.

Specification

Ingenane hexadecanoate , its cas register number is 37394-33-5. It also can be called 1H-2,8a-Methanocyclopenta(a)cyclopropa(e)cyclodecen-11-one, 2,5,5a,6,9,10,10a,1a-octahydro-4-hydroxymethyl-1,1,7,9-tetramethyl-5,5a,6-trihydroxy-, 5-hexadecanoate .