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4,7-Dichloroquinoline structure
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4,7-Dichloroquinoline

TL;DR: 4,7-Dichloroquinoline (CAS 86-98-6) is a chemical compound with molecular formula C9H5Cl2N and molecular weight 196.9799 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4,7-dichloroquinoline

Also Known As: 4,7-Dichloroquinoline, QUINOLINE, 4,7-DICHLORO-, Amodiaquine Impurity 1, 4,7-Dichloro-quinoline, 4,7-dichlorquinolin

CAS Number
86-98-6
Molecular Formula
C9H5Cl2N
Molecular Weight
196.9799 g/mol
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Application Areas

Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (39 patents) Analytical Reagents (3 patents) Biotechnology (4 patents) Coatings & Adhesives (10 patents) Electronic Chemicals (2 patents)

Technical Specifications

Molecular FormulaC9H5Cl2N
Molecular Weight196.9799 g/mol
XLogP3.6
Topological Polar Surface Area (TPSA)12.9 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors1
Rotatable Bonds0
Exact Mass196.9799 Da
Heavy Atoms12
Complexity163.0
Vapor Pressure0.00077 [mmHg]
SMILESC1=CC2=C(C=CN=C2C=C1Cl)Cl
InChIKeyHXEWMTXDBOQQKO-UHFFFAOYSA-N

Product Description

Applications: 4,7-Dichloroquinoline is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 4,7-Dichloroquinoline (CAS 86-98-6) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

4,7-Dichloroquinoline is a heterocyclic building block identified by CAS number 86-98-6 and the molecular formula C9H5Cl2N and a molecular weight of 196.98 g/mol. It is also known as 4,7-Dichloroquinoline and QUINOLINE, 4,7-DICHLORO-.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of 4,7-Dichloroquinoline

XLogP
3.6
TPSA (Topological Polar Surface Area)
12.9
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
Rotatable Bonds
0
Heavy Atoms
12
Complexity
163.0
Exact Mass
196.9799
Monoisotopic Mass
196.9799
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 4,7-Dichloroquinoline

The XLogP value of 3.6 indicates that 4,7-Dichloroquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.9 Ų, 4,7-Dichloroquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,7-Dichloroquinoline has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 4,7-Dichloroquinoline?

The CAS number of 4,7-Dichloroquinoline is 86-98-6.

What is the molecular formula of 4,7-Dichloroquinoline?

The molecular formula of 4,7-Dichloroquinoline is C9H5Cl2N.

What is the molecular weight of 4,7-Dichloroquinoline?

The molecular weight of 4,7-Dichloroquinoline is 196.9799 g/mol.

What are the applications of 4,7-Dichloroquinoline?

4,7-Dichloroquinoline is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 4,7-Dichloroquinoline (CAS...

Where can I buy 4,7-Dichloroquinoline?

You can request a quote for 4,7-Dichloroquinoline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 4,7-Dichloroquinoline?

Yes, CoreyChem provides custom synthesis services for 4,7-Dichloroquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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