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4,17a-Dimethyl-2-hydroxymethylene Testosterone

CAT: 1459-CS-T-53597Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-T-53597Size:1 Each
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Description
4,17a-Dimethyl-2-hydroxymethylene Testosterone is listed under Impurity and is intended for research and analytical applications. It is associated with Testosterone. This is a controlled substance entry for enquiry only. Any possible supply discussion is subject to due diligence, certification, permits, documentation, intended end-use and applicable compliance review. This controlled substance entry is shown for qualified research enquiry and compliance review, with product information including CAS number, molecular formula, molecular weight and enquiry details.
Overview
Useful research chemical for a range of applications.
CAS Number
38539-99-0
Synonyms
4,17a-Dimethyl-2-hydroxymethylene Testosterone
Additionnal Information
4,17a-Dimethyl-2-hydroxymethylene Testosterone is a controlled substance reference entry. Enquiries are reviewed for organization details, intended end-use, certifications, permits, documentation and applicable legal requirements before any possible supply discussion.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
Useful research chemical for a range of applications.
HSN Code
38229010
Hazard Compound
Refer MSDS for complete information.

Chemical Information

4,17alpha-Dimethyl-2-hydroxymethylene Testosterone
CAS Number38539-99-0
PubChem CID57349609
IUPAC Name(8R,9S,10R,13S,14S,17S)-17-hydroxy-2-(hydroxymethylidene)-4,10,13,17-tetramethyl-1,6,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
Molecular FormulaC22H32O3
Molecular Weight344.5
XLogP4.3
Topological Polar Surface Area57.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count25
Formal Charge0
Complexity689
SMILES
CC1=C2CC[C@H]3[C@@H]4CC[C@]([C@]4(CC[C@@H]3[C@]2(CC(=CO)C1=O)C)C)(C)O
InChI
InChI=1S/C22H32O3/c1-13-16-6-5-15-17(20(16,2)11-14(12-23)19(13)24)7-9-21(3)18(15)8-10-22(21,4)25/h12,15,17-18,23,25H,5-11H2,1-4H3/t15-,17+,18+,20+,21+,22+/m1/s1
InChIKey
TTXFXDNREBBNTM-UCLRZGAKSA-N
Chemical Structure
2D Structure
2D structure of 4,17alpha-Dimethyl-2-hydroxymethylene Testosterone
CAS: 38539-99-0
CID: 57349609
Formula: C22H32O3
MW: 344.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight344.5
XLogP34.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass344.23514488
Monoisotopic Mass344.23514488
Topological Polar Surface Area57.5 Ų
Heavy Atom Count25
Formal Charge0
Complexity689
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count1
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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