1-[(3S,8R,9S,10R,13S,14S,16S,17R)-3,17-dihydroxy-10,13,16-trimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]ethanone

Catalog No: FT-0772730

CAS No: 13900-61-3

Chemical Name: 1-[(3S,8R,9S,10R,13S,14S,16S,17R)-3,17-dihydroxy-10,13,16-trimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]ethanone
Molecular Formula: C22H34O3
Molecular Weight: 346.5
InChI Key: MDCCMZGGNCMFPQ-RGEWOSBMSA-N
InChI: InChI=1S/C22H34O3/c1-13-11-19-17-6-5-15-12-16(24)7-9-20(15,3)18(17)8-10-21(19,4)22(13,25)14(2)23/h5,13,16-19,24-25H,6-12H2,1-4H3/t13-,16-,17+,18-,19-,20-,21-,22-/m0/s1

Product pricing and availability information
Assay	Pack Size	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Product_Name:	17alpha-hydroxy-16beta-methylpregnenolone
MF:	C22H34O3
Bolling_Point:	483.9ºC at 760mmHg
Density:	1.13g/cm3
FW:	346.50400
Melting_Point:	224-230ºC
Flash_Point:	260.6ºC
CAS:	13900-61-3

MF:	C22H34O3
Bolling_Point:	483.9ºC at 760mmHg
Exact_Mass:	346.25100
More_Info:	['1 . Appearance 无可用 ', '2 . Density（g/mL,25/4℃）无可用 ', '3 . Relative vapor density（g/mL,Atmosphere =1）无可用 ', '4 . Melting point（ºC）224-230 ', '5 . Boiling point（ºC,Atmospheric pressure）无可用 ', '6 . Boiling point（ºC,52kPa）无可用 ', '7 . Refractive index无可用 ', '8 . Flash point（ºC）无可用 ', '9 . Specific rotation（º）无可用 ', '10 . Spontaneous ignition point or ignition temperature（ºC）无可用 ', '11 . Vapor pressure（kPa,25ºC）无可用 ', '12 . Saturated vapor pressure（kPa,60ºC）无可用 ', '13 . Combustion heat（KJ/mol）无可用 ', '14 . Critical temperature（ºC）无可用 ', '15 . Critical pressure（KPa）无可用 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion（%,V/V）无可用 ', '18 . Lower limit of explosion（%,V/V）无可用 ', '19 . Solubility 无可用']
Melting_Point:	224-230ºC
Refractive_Index:	1.561
PSA:	57.53000
Flash_Point:	260.6ºC
Density:	1.13g/cm3
Molecular_Structure:	['1 . Molar refractive index 9857 ', '2 . Molar volume （m3/mol）3031 ', '3 . Parachor （902K）7954 ', '4 表面张力（30 dyne/cm）474 ', '5 . Polarizability （05 10 -24cm 3）3907']
Computational_Chemistry:	['1 . XlogP 33 ', '2 . Hydrogen Bond Donor Count 2 ', '3 . Hydrogen Bond Acceptor Count 3 ', '4 . Rotatable Bond Count 1 ', '5 . TPSA 575 ', '6 . Heavy Atom Count 25 ', '7 . Topological Polar Surface Area 0 ', '8 . Complexity 625 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 8 ', '11 . Undefined Atom Stereocenter Count 0 ', '12 . Defined Bond Stereocenter Count 0 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 1']
FW:	346.50400
LogP:	3.87620
Vapor_Pressure:	2.14E-11mmHg at 25°C