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6-Hydroxy Chlorzoxazone-d2-15N

CAT: 1459-CS-P-07473Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-P-07473Size:1 Each
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Description
6-Hydroxy Chlorzoxazone-d2-15N is listed under Stable Isotopes and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Chlorzoxazone. The product is supplied by Clearsynth under CAT No. CS-P-07473. 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
1784060-40-7
Synonyms
6-Hydroxy Chlorzoxazone-d2-15N
Molecular Formula
C 7 H 2 ClD 215 NNO 3
Molecular Weight
188.57
Additionnal Information
6-Hydroxy Chlorzoxazone-d2-15N is supplied with detailed characterization data compliant with regulatory guideline. 6-Hydroxy Chlorzoxazone-d2-15N 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 Chlorzoxazone.
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

6-Hydroxy Chlorzoxazone-15N,d2
CAS Number1784060-40-7
PubChem CID117065122
IUPAC Name5-chloro-4,7-dideuterio-6-hydroxy-3H-1,3-benzoxazol-2-one
Molecular FormulaC7H4ClNO3
Molecular Weight188.57
XLogP1.4
Topological Polar Surface Area58.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count12
Formal Charge0
Complexity211
SMILES
[2H]C1=C2C(=C(C(=C1Cl)O)[2H])OC(=O)[15NH]2
InChI
InChI=1S/C7H4ClNO3/c8-3-1-4-6(2-5(3)10)12-7(11)9-4/h1-2,10H,(H,9,11)/i1D,2D,9+1
InChIKey
AGLXDWOTVQZHIQ-MRQHIAEYSA-N
Chemical Structure
2D Structure
2D structure of 6-Hydroxy Chlorzoxazone-15N,d2
CAS: 1784060-40-7
CID: 117065122
Formula: C7H4ClNO3
MW: 188.57
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight188.57
XLogP31.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass187.9975591
Monoisotopic Mass187.9975591
Topological Polar Surface Area58.6 Ų
Heavy Atom Count12
Formal Charge0
Complexity211
Isotope Atom Count3
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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