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N-Nitroso Vilazodone Impurity 5

CAT: 1459-CS-EO-03003Size: 1 EachDry Ice: NoHazardous: No
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Description
N-Nitroso Vilazodone Impurity 5 is listed under Nitrosamine and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Vilazodone. The product is supplied by Clearsynth under CAT No. CS-EO-03003. 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
2512217-82-0
Synonyms
N-Nitroso Vilazodone Impurity 5
Molecular Formula
C 15 H 17 N 3 O 4
Molecular Weight
303.31
Additionnal Information
N-Nitroso Vilazodone Impurity 5 is supplied with detailed characterization data compliant with regulatory guideline. N-Nitroso Vilazodone Impurity 5 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 Vilazodone.
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

5-(4-Nitrosopiperazin-1-yl)benzofuran-2-carboxylic Acid Ethyl Ester
CAS Number2512217-82-0
PubChem CID125327937
IUPAC Nameethyl 5-(4-nitrosopiperazin-1-yl)-1-benzofuran-2-carboxylate
Molecular FormulaC15H17N3O4
Molecular Weight303.31
XLogP2.7
Topological Polar Surface Area75.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Heavy Atom Count22
Formal Charge0
Complexity412
SMILES
CCOC(=O)C1=CC2=C(O1)C=CC(=C2)N3CCN(CC3)N=O
InChI
InChI=1S/C15H17N3O4/c1-2-21-15(19)14-10-11-9-12(3-4-13(11)22-14)17-5-7-18(16-20)8-6-17/h3-4,9-10H,2,5-8H2,1H3
InChIKey
VZSQOCJDKVAGSY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-(4-Nitrosopiperazin-1-yl)benzofuran-2-carboxylic Acid Ethyl Ester
CAS: 2512217-82-0
CID: 125327937
Formula: C15H17N3O4
MW: 303.31
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight303.31
XLogP32.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass303.12190603
Monoisotopic Mass303.12190603
Topological Polar Surface Area75.4 Ų
Heavy Atom Count22
Formal Charge0
Complexity412
Isotope Atom Count0
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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