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7-Hydroxy Warfarin-d5

CAT: 1459-CS-T-56333Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-T-56333Size:1 Each
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Description
7-Hydroxy Warfarin-d5 is listed under Stable Isotopes and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Warfarin. The product is supplied by Clearsynth under CAT No. CS-T-56333. 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
94820-65-2
Synonyms
7-Hydroxy Warfarin-d5
Molecular Formula
C 19 H 11 D 5 O 5
Molecular Weight
329.36
Additionnal Information
7-Hydroxy Warfarin-d5 is supplied with detailed characterization data compliant with regulatory guideline. 7-Hydroxy Warfarin-d5 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 Warfarin.
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

Phenyl-d5-7-hydroxywarfarin

See also: Phenyl-D(5)-hydroxywarfarin (annotation moved to).

CAS Number94820-65-2
PubChem CID71311832
IUPAC Name4,7-dihydroxy-3-[3-oxo-1-(2,3,4,5,6-pentadeuteriophenyl)butyl]chromen-2-one
Molecular FormulaC19H16O5
Molecular Weight329.4
XLogP2.3
Topological Polar Surface Area83.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count24
Formal Charge0
Complexity532
SMILES
[2H]C1=C(C(=C(C(=C1[2H])[2H])C(CC(=O)C)C2=C(C3=C(C=C(C=C3)O)OC2=O)O)[2H])[2H]
InChI
InChI=1S/C19H16O5/c1-11(20)9-15(12-5-3-2-4-6-12)17-18(22)14-8-7-13(21)10-16(14)24-19(17)23/h2-8,10,15,21-22H,9H2,1H3/i2D,3D,4D,5D,6D
InChIKey
SKFYEJMLNMTTJA-VIQYUKPQSA-N
Chemical Structure
2D Structure
2D structure of Phenyl-d5-7-hydroxywarfarin
CAS: 94820-65-2
CID: 71311832
Formula: C19H16O5
MW: 329.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight329.4
XLogP32.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass329.13115734
Monoisotopic Mass329.13115734
Topological Polar Surface Area83.8 Ų
Heavy Atom Count24
Formal Charge0
Complexity532
Isotope Atom Count5
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
CS-T-959458-Hydroxy Warfarin-d5
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CS-O-03021R- (+) -Warfarin-d5
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CS-T-78278Rac 7-Hydroxy Propranolol-d5
CS-O-45016Hydroxy Pentoxifylline-d5
CS-O-10379Warfarin
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Alternative Products

CatalogName
TRC-H996132-1MG7-Hydroxy Warfarin-d5
TRC-H996127-25MG(R)-7-Hydroxy Warfarin-d5
0146637-Hydroxy Warfarin-d5 discontinued
TRC-H996128-25MG(S)-7-Hydroxy Warfarin-d5
sc-2175008-Hydroxy Warfarin-d5
TRC-H996122-100MG6-Hydroxy Warfarin-d5
TRC-H996130-5MG7-Hydroxy Warfarin
0146606-Hydroxy Warfarin-d5 discontinued
0146658-Hydroxy Warfarin-d5 discontinued
279240-017-Hydroxy warfarin discontinued

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