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2-Chloro-5-nitrotoluene

CAT: 1459-CS-ED-02102Size: 1 EachDry Ice: NoHazardous: No
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Description
2-Chloro-5-nitrotoluene is listed under Impurity and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Toltrazuril. The product is supplied by Clearsynth under CAT No. CS-ED-02102. 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
13290-74-9
Synonyms
2-Chloro-5-nitrotoluene
Molecular Formula
C 7 H 6 ClNO 2
Molecular Weight
171.58
Additionnal Information
2-Chloro-5-nitrotoluene is supplied with detailed characterization data compliant with regulatory guideline. 2-Chloro-5-nitrotoluene 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 Toltrazuril.
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

Benzene, 1-chloro-2-methyl-4-nitro-
CAS Number13290-74-9
PubChem CID83315
IUPAC Name1-chloro-2-methyl-4-nitrobenzene
Molecular FormulaC7H6ClNO2
Molecular Weight171.58
XLogP3.3
Topological Polar Surface Area45.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity157
SMILES
CC1=C(C=CC(=C1)[N+](=O)[O-])Cl
InChI
InChI=1S/C7H6ClNO2/c1-5-4-6(9(10)11)2-3-7(5)8/h2-4H,1H3
InChIKey
BGDCQZFFNFXYQC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzene, 1-chloro-2-methyl-4-nitro-
CAS: 13290-74-9
CID: 83315
Formula: C7H6ClNO2
MW: 171.58
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight171.58
XLogP33.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass171.0087061
Monoisotopic Mass171.0087061
Topological Polar Surface Area45.8 Ų
Heavy Atom Count11
Formal Charge0
Complexity157
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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