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Verapamil 5-chloro impurity

CAT: 1459-CS-T-50642Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-T-50642Size:1 Each
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Description
Verapamil 5-chloro impurity is listed under Impurity and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Verapamil. The product is supplied by Clearsynth under CAT No. CS-T-50642. 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
27487-83-8
Synonyms
Verapamil 5-chloro impurity
Molecular Formula
C 16 H 22 ClNO 2
Molecular Weight
295.80
Additionnal Information
Verapamil 5-chloro impurity is supplied with detailed characterization data compliant with regulatory guideline. Verapamil 5-chloro impurity 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 Verapamil.
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-Chloro-2-(3,4-dimethoxyphenyl)-2-isopropylvaleronitrile
CAS Number27487-83-8
PubChem CID619953
IUPAC Name5-chloro-2-(3,4-dimethoxyphenyl)-2-propan-2-ylpentanenitrile
Molecular FormulaC16H22ClNO2
Molecular Weight295.80
XLogP2.4
Topological Polar Surface Area42.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Heavy Atom Count20
Formal Charge0
Complexity339
SMILES
CC(C)C(CCCCl)(C#N)C1=CC(=C(C=C1)OC)OC
InChI
InChI=1S/C16H22ClNO2/c1-12(2)16(11-18,8-5-9-17)13-6-7-14(19-3)15(10-13)20-4/h6-7,10,12H,5,8-9H2,1-4H3
InChIKey
VDQLTWSIHIWIFQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Chloro-2-(3,4-dimethoxyphenyl)-2-isopropylvaleronitrile
CAS: 27487-83-8
CID: 619953
Formula: C16H22ClNO2
MW: 295.80
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight295.80
XLogP32.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Exact Mass295.1339066
Monoisotopic Mass295.1339066
Topological Polar Surface Area42.3 Ų
Heavy Atom Count20
Formal Charge0
Complexity339
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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