(3-Benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid
TL;DR: (3-Benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid (CAS 125674-65-9) is a chemical compound with molecular formula C10H12NO4P and molecular weight 241.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid
Also Known As: 3-Benzyl-2-isoxazolin-5-ylphosphonic acid, (3-benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid, (4,5-Dihydro-3-(phenylmethyl)-5-isoxazolyl)phosphonic acid, Phosphonic acid, (4,5-dihydro-3-(phenylmethyl)-5-isoxazolyl)-, RefChem:1050087
| Molecular Formula | C10H12NO4P |
|---|---|
| Molecular Weight | 241.05 g/mol |
| LogP | 1.5092 |
| Topological Polar Surface Area | 79.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.0504 |
| Heavy Atoms | 16 |
| Complexity | 439.39206 |
Chemical Identifiers
| CAS Number | 125674-65-9 |
|---|---|
| SMILES | C1C(ON=C1CC2=CC=CC=C2)P(=O)(O)O |
Product Overview
(3-Benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid (CAS 125674-65-9), with molecular formula C10H12NO4P and molecular weight 241.05 g/mol. IUPAC: (3-benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid.
Chemical Property Profile of (3-Benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid
Property Insights of (3-Benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid
The XLogP value of 1.5092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid. The TPSA of 79.12 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid. Following Lipinski's Rule of Five, (3-Benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid has 2 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 (3-Benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid?
The CAS number of (3-Benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid is 125674-65-9.
What is the molecular formula of (3-Benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid?
The molecular formula of (3-Benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid is C10H12NO4P.
What is the molecular weight of (3-Benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid?
The molecular weight of (3-Benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid is 241.05 g/mol.
Where can I buy (3-Benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid?
You can request a quote for (3-Benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid?
Yes, KEHONG BIO provides custom synthesis services for (3-Benzyl-4,5-dihydro-1,2-oxazol-5-yl)phosphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.