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Testosterone Impurity 105

CAT: 1299-RM-T691605-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-T691605-02Size:25 mg
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CAS Number
7219-21-8
Synonyms
(8R,9S,10R,13S,14S,17S) -10,13-dimethyl-3-oxo-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl undecanoate
Molecular Formula
C30H46O3
Molecular Weight
454.7
Target Alternative Name
Testosterone
Product Name Synonym
(8R,9S,10R,13S,14S,17S) -10,13-dimethyl-3-oxo-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl undecanoate

Chemical Information

Boldenone undecanoate
CAS Number7219-21-8
PubChem CID92033205
IUPAC Name[(8R,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] undecanoate
Molecular FormulaC30H46O3
Molecular Weight454.7
XLogP8.7
Topological Polar Surface Area43.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count11
Heavy Atom Count33
Formal Charge0
Complexity779
SMILES
CCCCCCCCCCC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)C=C[C@]34C)C
InChI
InChI=1S/C30H46O3/c1-4-5-6-7-8-9-10-11-12-28(32)33-27-16-15-25-24-14-13-22-21-23(31)17-19-29(22,2)26(24)18-20-30(25,27)3/h17,19,21,24-27H,4-16,18,20H2,1-3H3/t24-,25-,26-,27-,29-,30-/m0/s1
InChIKey
YRLFCTLEPMMSHQ-CNQKSJKFSA-N
Chemical Structure
2D Structure
2D structure of Boldenone undecanoate
CAS: 7219-21-8
CID: 92033205
Formula: C30H46O3
MW: 454.7
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight454.7
XLogP38.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count11
Exact Mass454.34469533
Monoisotopic Mass454.34469533
Topological Polar Surface Area43.4 Ų
Heavy Atom Count33
Formal Charge0
Complexity779
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes