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o-Tolylbiguanide structure
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o-Tolylbiguanide

TL;DR: o-Tolylbiguanide (CAS 93-69-6) is a chemical compound with molecular formula C9H13N5 and molecular weight 191.1171 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-(diaminomethylidene)-2-(2-methylphenyl)guanidine

Also Known As: 1-(o-Tolyl)biguanide, o-Tolylbiguanide, Sopanox, Aliant, 2-Tolylbiguanide

CAS Number
93-69-6
Molecular Formula
C9H13N5
Molecular Weight
191.1171 g/mol
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Application Areas

Top 5 of 20 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (19 patents) Analytical Reagents (1 patents) Catalysts (12 patents) Coatings & Adhesives (112 patents) Construction Chemicals (3 patents)

Technical Specifications

Molecular FormulaC9H13N5
Molecular Weight191.1171 g/mol
XLogP0.3
Topological Polar Surface Area (TPSA)103.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors1
Rotatable Bonds2
Exact Mass191.1171 Da
Heavy Atoms14
Complexity242.0
SMILESCC1=CC=CC=C1N=C(N)N=C(N)N
InChIKeySQZCAOHYQSOZCE-UHFFFAOYSA-N

Product Description

Applications: o-Tolylbiguanide is used in polymer additives and plastics compounding, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

o-Tolylbiguanide is a plastic additive identified by CAS number 93-69-6 and the molecular formula C9H13N5 and a molecular weight of 191.12 g/mol. Synonyms include 1-(o-Tolyl)biguanide and o-Tolylbiguanide.

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 o-Tolylbiguanide

XLogP
0.3
TPSA (Topological Polar Surface Area)
103.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
1
Rotatable Bonds
2
Heavy Atoms
14
Complexity
242.0
Exact Mass
191.1171
Monoisotopic Mass
191.1171
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 o-Tolylbiguanide

The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for o-Tolylbiguanide. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for o-Tolylbiguanide. Following Lipinski's Rule of Five, o-Tolylbiguanide has 3 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 o-Tolylbiguanide?

The CAS number of o-Tolylbiguanide is 93-69-6.

What is the molecular formula of o-Tolylbiguanide?

The molecular formula of o-Tolylbiguanide is C9H13N5.

What is the molecular weight of o-Tolylbiguanide?

The molecular weight of o-Tolylbiguanide is 191.1171 g/mol.

What are the applications of o-Tolylbiguanide?

o-Tolylbiguanide is used in polymer additives and plastics compounding, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton...

Where can I buy o-Tolylbiguanide?

You can request a quote for o-Tolylbiguanide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for o-Tolylbiguanide?

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

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