3-Methylphenyl diphenylphosphinate
TL;DR: 3-Methylphenyl diphenylphosphinate (CAS 21856-10-0) is a chemical compound with molecular formula C19H17O2P and molecular weight 308.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-diphenylphosphoryloxy-3-methylbenzene
Also Known As: 3-methylphenyl diphenylphosphinate, 1-diphenylphosphoryloxy-3-methylbenzene, Phosphinic acid,P,P-diphenyl-, 3-methylphenyl ester
| Molecular Formula | C19H17O2P |
|---|---|
| Molecular Weight | 308.10 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.09662 |
| Heavy Atoms | 22 |
| Complexity | 361.0 |
Chemical Identifiers
| CAS Number | 21856-10-0 |
|---|---|
| SMILES | CC1=CC(=CC=C1)OP(=O)(C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | CRWZFIKUPVUVFU-UHFFFAOYSA-N |
Product Overview
3-Methylphenyl diphenylphosphinate (CAS 21856-10-0), with molecular formula C19H17O2P and molecular weight 308.10 g/mol. IUPAC: 1-diphenylphosphoryloxy-3-methylbenzene.
Chemical Property Profile of 3-Methylphenyl diphenylphosphinate
Property Insights of 3-Methylphenyl diphenylphosphinate
The XLogP value of 4.7 indicates that 3-Methylphenyl diphenylphosphinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 3-Methylphenyl diphenylphosphinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methylphenyl diphenylphosphinate has 0 hydrogen bond donor(s) and 2 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-Methylphenyl diphenylphosphinate?
The CAS number of 3-Methylphenyl diphenylphosphinate is 21856-10-0.
What is the molecular formula of 3-Methylphenyl diphenylphosphinate?
The molecular formula of 3-Methylphenyl diphenylphosphinate is C19H17O2P.
What is the molecular weight of 3-Methylphenyl diphenylphosphinate?
The molecular weight of 3-Methylphenyl diphenylphosphinate is 308.10 g/mol.
Where can I buy 3-Methylphenyl diphenylphosphinate?
You can request a quote for 3-Methylphenyl diphenylphosphinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methylphenyl diphenylphosphinate?
Yes, KEHONG BIO provides custom synthesis services for 3-Methylphenyl diphenylphosphinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.