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16-Dehydropregnenolone Acetate

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16-Dehydropregnenolone Acetate / CAS : 979-02-2

Appearance White crystalline powder UN 0.0
HS 29372900 DG Class 0.0
Synonyms 16-DPA; 3β-Hydroxy-5,16-Pregnadien-20-one Acetate; 3β-Acetoxy-5,16-Pregnadien-20-one; 5,16-Pregnadien-3β-ol-20-one Acetate; Dehydropregnenolone Acetate; 16,17-Didehydropregnenolone Acetate
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Properties

Summary

Formula
C23H32O3
Molecular Mass
356.49800
Exact Mass
356.23500
PSA
43.37000
Logp
5.00620
IUPAC
[(3S,8R,9S,10R,13S,14S)-17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
SMILES
CC(=O)C1=CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)C)C)C

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Intermediates

Chemical and Physical Properties

Melting Point
170-178°C
Density
1.11±0.1 g/cm3(Predicted)
Boiling Point
464.4±45.0 °C(Predicted)
Flash Point
200.1ºC
Appearance
White crystalline powder
Acidity and Basicity
neutral

Export information

HS Code
29372900
Export Rebate
13%
UN No.
0.0
DG-Class
0.0
Risk Code
R36/37/38
Safety Label
Xi

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