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Dimethyl [(2-methylphenyl)methyl]phosphonate
TL;DR: Dimethyl [(2-methylphenyl)methyl]phosphonate (CAS 17105-62-3) is a chemical compound with molecular formula C10H15O3P and molecular weight 214.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(dimethoxyphosphorylmethyl)-2-methylbenzene
Also Known As: Dimethyl(2-methylbenzyl)phosphonate, dimethyl [(2-methylphenyl)methyl]phosphonate, Dimethyl 2-methylbenzylphosphonate, 1-(dimethoxyphosphorylmethyl)-2-methylbenzene, 1-(dimethoxyphosphorylmethyl)-2-methyl-benzene
| Molecular Formula | C10H15O3P |
|---|---|
| Molecular Weight | 214.08 g/mol |
| LogP | 2.98092 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 214.07588 |
| Heavy Atoms | 14 |
| Complexity | 340.97528 |
Chemical Identifiers
| CAS Number | 17105-62-3 |
|---|---|
| SMILES | CC1=CC=CC=C1CP(=O)(OC)OC |
Product Overview
Dimethyl [(2-methylphenyl)methyl]phosphonate (CAS 17105-62-3), with molecular formula C10H15O3P and molecular weight 214.08 g/mol. IUPAC: 1-(dimethoxyphosphorylmethyl)-2-methylbenzene.
Chemical Property Profile of Dimethyl [(2-methylphenyl)methyl]phosphonate
Property Insights of Dimethyl [(2-methylphenyl)methyl]phosphonate
The XLogP value of 2.98092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl [(2-methylphenyl)methyl]phosphonate. With a topological polar surface area (TPSA) of 35.53 Ų, Dimethyl [(2-methylphenyl)methyl]phosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyl [(2-methylphenyl)methyl]phosphonate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dimethyl [(2-methylphenyl)methyl]phosphonate?
The CAS number of Dimethyl [(2-methylphenyl)methyl]phosphonate is 17105-62-3.
What is the molecular formula of Dimethyl [(2-methylphenyl)methyl]phosphonate?
The molecular formula of Dimethyl [(2-methylphenyl)methyl]phosphonate is C10H15O3P.
What is the molecular weight of Dimethyl [(2-methylphenyl)methyl]phosphonate?
The molecular weight of Dimethyl [(2-methylphenyl)methyl]phosphonate is 214.08 g/mol.
Where can I buy Dimethyl [(2-methylphenyl)methyl]phosphonate?
You can request a quote for Dimethyl [(2-methylphenyl)methyl]phosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl [(2-methylphenyl)methyl]phosphonate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl [(2-methylphenyl)methyl]phosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.