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2-[(2,6-Dichlorophenyl)methylideneamino]guanidine structure
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2-[(2,6-Dichlorophenyl)methylideneamino]guanidine

TL;DR: 2-[(2,6-Dichlorophenyl)methylideneamino]guanidine (CAS 5051-62-7) is a chemical compound with molecular formula C8H8Cl2N4 and molecular weight 230.0126 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[(2,6-dichlorophenyl)methylideneamino]guanidine

Also Known As: guanabenz, Extraneal, Spectrum2_001114, Spectrum3_000445, Spectrum4_000567

CAS Number
5051-62-7
Molecular Formula
C8H8Cl2N4
Molecular Weight
230.0126 g/mol
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Application Areas

Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (2 patents) Food Additives (2 patents) Heterocyclic Building Blocks (3 patents) Organic Building Blocks (1 patents) Pharmaceutical Intermediates (24 patents)

Technical Specifications

Molecular FormulaC8H8Cl2N4
Molecular Weight230.0126 g/mol
XLogP1.7
Topological Polar Surface Area (TPSA)76.8 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors2
Rotatable Bonds2
Exact Mass230.0126 Da
Heavy Atoms14
Complexity227.0
Melting Point228 °C
Solubility8.89e-02 g/L
SMILESC1=CC(=C(C(=C1)Cl)C=NN=C(N)N)Cl
InChIKeyWDZVGELJXXEGPV-UHFFFAOYSA-N

Product Description

Applications: 2-[(2,6-Dichlorophenyl)methylideneamino]guanidine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 2-[(2,6-Dichlorophenyl)methylideneamino]guanidine (CAS 5051-62-7) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

2-[(2,6-Dichlorophenyl)methylideneamino]guanidine (CAS 5051-62-7) is a pharmaceutical intermediate with the molecular formula C8H8Cl2N4 and a molecular weight of 230.01 g/mol. Key physical properties include a solubility: 8.89e-02 g/L. It is also known as guanabenz and Extraneal.

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 2-[(2,6-Dichlorophenyl)methylideneamino]guanidine

XLogP
1.7
TPSA (Topological Polar Surface Area)
76.8
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
2
Rotatable Bonds
2
Heavy Atoms
14
Complexity
227.0
Exact Mass
230.0126
Monoisotopic Mass
230.0126
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 2-[(2,6-Dichlorophenyl)methylideneamino]guanidine

The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(2,6-Dichlorophenyl)methylideneamino]guanidine. The TPSA of 76.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2,6-Dichlorophenyl)methylideneamino]guanidine. Following Lipinski's Rule of Five, 2-[(2,6-Dichlorophenyl)methylideneamino]guanidine has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-[(2,6-Dichlorophenyl)methylideneamino]guanidine?

The CAS number of 2-[(2,6-Dichlorophenyl)methylideneamino]guanidine is 5051-62-7.

What is the molecular formula of 2-[(2,6-Dichlorophenyl)methylideneamino]guanidine?

The molecular formula of 2-[(2,6-Dichlorophenyl)methylideneamino]guanidine is C8H8Cl2N4.

What is the molecular weight of 2-[(2,6-Dichlorophenyl)methylideneamino]guanidine?

The molecular weight of 2-[(2,6-Dichlorophenyl)methylideneamino]guanidine is 230.0126 g/mol.

What are the applications of 2-[(2,6-Dichlorophenyl)methylideneamino]guanidine?

2-[(2,6-Dichlorophenyl)methylideneamino]guanidine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies...

Where can I buy 2-[(2,6-Dichlorophenyl)methylideneamino]guanidine?

You can request a quote for 2-[(2,6-Dichlorophenyl)methylideneamino]guanidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-[(2,6-Dichlorophenyl)methylideneamino]guanidine?

Yes, CoreyChem provides custom synthesis services for 2-[(2,6-Dichlorophenyl)methylideneamino]guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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