2-(phosphonomethyl)phenol
TL;DR: 2-(phosphonomethyl)phenol (CAS 17045-27-1) is a chemical compound with molecular formula C7H9O4P and molecular weight 188.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-hydroxyphenyl)methylphosphonic acid
Also Known As: 2-(phosphonomethyl)phenol, (2-hydroxyphenyl)methylphosphonic acid, o-hydroxybenzylphosphonic acid, (2-Hydroxybenzyl)phosphonic acid, [(2-hydroxyphenyl)methyl]phosphonic acid
| Molecular Formula | C7H9O4P |
|---|---|
| Molecular Weight | 188.02 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.02385 |
| Heavy Atoms | 12 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 17045-27-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CP(=O)(O)O)O |
| InChIKey | OBIWKSIDJBJZSC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(phosphonomethyl)phenol (CAS 17045-27-1), with molecular formula C7H9O4P and molecular weight 188.02 g/mol. IUPAC: (2-hydroxyphenyl)methylphosphonic acid.
Chemical Property Profile of 2-(phosphonomethyl)phenol
Property Insights of 2-(phosphonomethyl)phenol
The XLogP value of -1.0 indicates that 2-(phosphonomethyl)phenol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(phosphonomethyl)phenol. Following Lipinski's Rule of Five, 2-(phosphonomethyl)phenol has 3 hydrogen bond donor(s) and 4 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 2-(phosphonomethyl)phenol?
The CAS number of 2-(phosphonomethyl)phenol is 17045-27-1.
What is the molecular formula of 2-(phosphonomethyl)phenol?
The molecular formula of 2-(phosphonomethyl)phenol is C7H9O4P.
What is the molecular weight of 2-(phosphonomethyl)phenol?
The molecular weight of 2-(phosphonomethyl)phenol is 188.02 g/mol.
Where can I buy 2-(phosphonomethyl)phenol?
You can request a quote for 2-(phosphonomethyl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(phosphonomethyl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-(phosphonomethyl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.