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Methenolone Acetate

CAT: 0572-TRC-M226250-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-M226250-1GSize:1 g
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CAS Number
434-05-9
Synonyms
Androst-1-en-3-one, 17-(acetyloxy)-1-methyl-, (5α,17β)-; Methenolone Acetate; 5α-Androst-1-en-3-one, 17β-hydroxy-1-methyl-, acetate (6CI,8CI); (5α,17β)-17-(Acetyloxy)-1-methylandrost-1-en-3-one; 1-Methyl-17β-hydroxy-5α-androst-1-en-3-one acetate; 1-Methyl-17β-hydroxy-5α-androst-1-en-3-one-17β-acetate; 1-Methyl-5α-androst-1-en-17β-ol-3-one acetate; 17β-Hydroxy-1-methyl-5α-androst-1-en-3-one acetate; Metenolone acetate; Methenolone 17-acetate; Methenolone acetate; NSC 74226; Nibal; Primobolan; Primobolan Tablets; Primobolone; Primonabol; SH 567; SH 567a; SQ 16496
Hazard Statement
Suspected of causing cancer
Purity
>95% (HPLC)
Smiles
CC(=O)O[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=O)C=C(C)[C@]4(C)[C@H]3CC[C@]12C
Molecular Formula
C22 H32 O3
Molecular Weight
344.49
InChI
InChI=1S/C22H32O3/c1-13-11-16(24)12-15-5-6-17-18-7-8-20(25-14(2)23)21(18,3)10-9-19(17)22(13,15)4/h11,15,17-20H,5-10,12H2,1-4H3/t15-,17-,18-,19-,20-,21-,22-/m0/s1
Additionnal Information
IUPAC name: [(5S,8R,9S,10S,13S,14S,17S)-1,10,13-trimethyl-3-oxo-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl] acetate
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Methenolone Acetate

Methenolone acetate is a steroid ester.

CAS Number434-05-9
PubChem CID252372
IUPAC Name[(5S,8R,9S,10S,13S,14S,17S)-1,10,13-trimethyl-3-oxo-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl] acetate
Molecular FormulaC22H32O3
Molecular Weight344.5
XLogP4.4
Topological Polar Surface Area43.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count25
Formal Charge0
Complexity635
SMILES
CC1=CC(=O)C[C@H]2[C@]1([C@H]3CC[C@]4([C@H]([C@@H]3CC2)CC[C@@H]4OC(=O)C)C)C
InChI
InChI=1S/C22H32O3/c1-13-11-16(24)12-15-5-6-17-18-7-8-20(25-14(2)23)21(18,3)10-9-19(17)22(13,15)4/h11,15,17-20H,5-10,12H2,1-4H3/t15-,17-,18-,19-,20-,21-,22-/m0/s1
InChIKey
PGAUJQOPTMSERF-QWQRBHLCSA-N
Chemical Structure
2D Structure
2D structure of Methenolone Acetate
CAS: 434-05-9
CID: 252372
Formula: C22H32O3
MW: 344.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight344.5
XLogP34.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass344.23514488
Monoisotopic Mass344.23514488
Topological Polar Surface Area43.4 Ų
Heavy Atom Count25
Formal Charge0
Complexity635
Isotope Atom Count0
Defined Atom Stereocenter Count7
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes