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Structure

Androstenediol-3-acetate-17-benzoate

CAS
5953-63-9
Catalog Number
ACM5953639
Category
Other Products
Molecular Weight
436.58
Molecular Formula
C28H36O4

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Specification

Synonyms
5-ANDROSTEN-3-BETA, 17-BETA-DIOL 3-ACETATE, 17-BENZOATE;ANDROSTENDIOL ACETATE 17-BENZOATE;ANDROSTENEDIOL-3-ACETATE-17-BENZOATE;BENZOIC ACID (3S,8R,9S,10R,13S,14S,17S)-3-ACETOXY-10,13-DIMETHYL-2,3,4,7,8,9,10,11,12,13,14,15,16,17-TETRADECAHYDRO-1H-CYCLOPEN
IUPAC Name
(3-acetyloxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl) benzoate
Canonical SMILES
CC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4OC(=O)C5=CC=CC=C5)C)C
InChI Key
JVRUDYNTKOCRNP-UHFFFAOYSA-N
Boiling Point
526.4ºC at 760 mmHg
Flash Point
256.9ºC
Density
1.15g/cm³
EC Number
227-717-3
Exact Mass
436.26100
H-Bond Acceptor
4
H-Bond Donor
0
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