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4-Methoxy-d3 17-beta-estradiol

CAT: 1459-CS-T-57699Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-T-57699Size:1 Each
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Description
4-Methoxy-d3 17-beta-estradiol is listed under Stable Isotopes and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Estradiol. The product is supplied by Clearsynth under CAT No. CS-T-57699. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
Useful research chemical for a range of applications.
CAS Number
1334143-12-2
Synonyms
4-Methoxy-d3 17-beta-estradiol
Molecular Formula
C 19 H 23 D 3 O 3
Molecular Weight
305.43
Additionnal Information
4-Methoxy-d3 17-beta-estradiol is supplied with detailed characterization data compliant with regulatory guideline. 4-Methoxy-d3 17-beta-estradiol can be used for analytical method development, method validation (AMV), Quality Control (QC) application for Abbreviated New Drug Application (ANDA), or during commercial production of Estradiol.
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

(8R,9S,13S,14S,17S)-13-methyl-4-(trideuteriomethoxy)-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
CAS Number1334143-12-2
PubChem CID131668204
IUPAC Name(8R,9S,13S,14S,17S)-13-methyl-4-(trideuteriomethoxy)-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
Molecular FormulaC19H26O3
Molecular Weight305.4
XLogP4
Topological Polar Surface Area49.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count22
Formal Charge0
Complexity425
SMILES
[2H]C([2H])([2H])OC1=C(C=CC2=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4O)C)O
InChI
InChI=1S/C19H26O3/c1-19-10-9-12-11-5-7-16(20)18(22-2)14(11)4-3-13(12)15(19)6-8-17(19)21/h5,7,12-13,15,17,20-21H,3-4,6,8-10H2,1-2H3/t12-,13-,15+,17+,19+/m1/s1/i2D3
InChIKey
BCWZIZLVBYHFES-DXWICUSKSA-N
Chemical Structure
2D Structure
2D structure of (8R,9S,13S,14S,17S)-13-methyl-4-(trideuteriomethoxy)-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
CAS: 1334143-12-2
CID: 131668204
Formula: C19H26O3
MW: 305.4
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight305.4
XLogP34
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass305.20702492
Monoisotopic Mass305.20702492
Topological Polar Surface Area49.7 Ų
Heavy Atom Count22
Formal Charge0
Complexity425
Isotope Atom Count3
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
sc-2169174-Methoxy-d3-17β-estradiol
sc-2169074-Methoxy-17β-estradiol-16,16,17-d3
0162202-Methoxy-d3 17β-Estradiol
sc-2162362-Methoxy-d3-17β-estradiol
0162224-Methoxy 17β-Estradiol
sc-210108A4-Methoxy-17β-estradiol
TRC-M262633-25MG4-Methoxy 17beta-Estradiol-16,16,17-d3
sc-2162272-Methoxy-17β-estradiol-16,16,17-d3
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