(3-methylphenyl)methylphosphonic Acid

Base Information

• Chemical Name: (3-methylphenyl)methylphosphonic Acid
• CAS No.: 18945-65-8
• Molecular Formula: C₈H₁₁O₃P
• Molecular Weight: 186.147
• Hs Code.: 2931900090
• DSSTox Substance ID: DTXSID90378720
• Wikidata: Q82168269
• Mol file: 18945-65-8.mol

Synonyms:18945-65-8;3-Methylbenzylphosphonic acid;(3-methylphenyl)methylphosphonic Acid;(3-Methylbenzyl)phosphonic acid;Phosphonic acid,P-[(3-methylphenyl)methyl]-;SCHEMBL7646261;DTXSID90378720;MFCD03411186;AKOS015911997;[(3-methylphenyl)methyl]phosphonic acid;PS-11638;CS-0324089;J-012227

Chemical Property of (3-methylphenyl)methylphosphonic Acid

Chemical Property:

• Vapor Pressure: 1.19E-06mmHg at 25°C
• Refractive Index: 1.564
• Boiling Point: 386.1 °C at 760 mmHg
• Flash Point: 187.3 °C
• PSA: 67.34000
• Density: 1.318 g/cm³
• LogP: 1.67270
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 186.04458121
• Heavy Atom Count: 12
• Complexity: 187

Purity/Quality:

98% ^*data from raw suppliers

3-Methylbenzylphosphonicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=CC=C1)CP(=O)(O)O

Technology Process of (3-methylphenyl)methylphosphonic Acid

There total 1 articles about (3-methylphenyl)methylphosphonic Acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

→ m-methylbenzylphosphonic acid (18945-65-8)

Guidance literature:

m-Xylylchlorid, roter P, Iod;

Reference yield:

m-methylbenzylphosphonic acid (18945-65-8) → (3-methyl-4-nitrophenylmethyl)phosphonic acid

Guidance literature:

With sulfuric acid; nitric acid; at 0 ℃;

DOI:10.1246/bcsj.60.277

Refernces