641-80-5

Basic information

• Product Name: 17-hydroxypregnenedione
• Synonyms: 17-hydroxypregnenedione;17alpha-hydroxypregn-5-ene-3,20-dione
• CAS NO: 641-80-5
• Molecular Formula: C₂₁H₃₀O₃
• Molecular Weight: 330.46
• Mol File: 641-80-5.mol
• Article Data: 1

Chemical Properties

• Boiling Point: 475.6°C at 760 mmHg
• Flash Point: 255.6°C
• Appearance: /
• Density: 1.15g/cm³
• Vapor Pressure: 4.81E-11mmHg at 25°C
• Refractive Index: 1.56
• CAS DataBase Reference: 17-hydroxypregnenedione(CAS DataBase Reference)
• NIST Chemistry Reference: 17-hydroxypregnenedione(641-80-5)
• EPA Substance Registry System: 17-hydroxypregnenedione(641-80-5)

Safety Data

• Hazardous Substances Data: 641-80-5(Hazardous Substances Data)

Usage

Definition

ChEBI: A C21-steroid that is pregnane which contains a double bond between positions 5 and 6 and is substituted by oxo groups at positions 3 and 20 as well as a hydroxy group at position 17.

InChI:InChI=1/C21H30O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h4,16-18,24H,5-12H2,1-3H3/t16-,17+,18+,19+,20+,21+/m1/s1

Upstream product

• 1048-89-1 3,5-pregnadien-3,17-diol-20-one-3-methyl ether 

Relevant articles and documents

Synthesis of [3α-3H] 17α-Hydroxy pregnenolone and [3α-3H] Pregnenolone

For the first time, [3α-3H] 17α-hydroxy pregnenolone (1) was synthesized through a multiple step sequence. The presence of [3β-3H] isomer in RP-HPLC purified product was identified by tritium NMR. The [3β-3H] isomer was then separated from [3α-3H] 17α-hydroxy pregnenolone with chiralPAK AD-H column. [3α-3H] pregnenolone (2) was synthesized from commercial available 5-pregnen-3,20-dione in one step with an improved procedure. [3α-3H] 17α-hydroxy pregnenolone (1) was synthesized through a multiple step sequence. The presence of [3β- 3H] isomer was identified then separated with chiralPAK AD-H column. [3α-3H] pregnenolone (2) was synthesized from commercial available 5-pregnen-3,20-dione in one step. Copyright