Methyl phenyl terephthalate
TL;DR: Methyl phenyl terephthalate (CAS 6725-72-0) is a chemical compound with molecular formula C15H12O4 and molecular weight 256.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-O-methyl 4-O-phenyl benzene-1,4-dicarboxylate
Also Known As: Methyl phenyl terephthalate, Methyl phenyl benzene-1,4-dicarboxylate, Terephthalic acid 1-methyl 4-phenyl ester, Terephthalic acid 1-phenyl 4-methyl ester, 1-O-methyl 4-O-phenyl benzene-1,4-dicarboxylate
| Molecular Formula | C15H12O4 |
|---|---|
| Molecular Weight | 256.07 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 256.07355 |
| Heavy Atoms | 19 |
| Complexity | 312.0 |
Chemical Identifiers
| CAS Number | 6725-72-0 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2 |
| InChIKey | BDVAPCAHRXXXOF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl phenyl terephthalate (CAS 6725-72-0), with molecular formula C15H12O4 and molecular weight 256.07 g/mol. IUPAC: 1-O-methyl 4-O-phenyl benzene-1,4-dicarboxylate.
Chemical Property Profile of Methyl phenyl terephthalate
Property Insights of Methyl phenyl terephthalate
The XLogP value of 3.4 indicates that Methyl phenyl terephthalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Methyl phenyl terephthalate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl phenyl terephthalate has 0 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 Methyl phenyl terephthalate?
The CAS number of Methyl phenyl terephthalate is 6725-72-0.
What is the molecular formula of Methyl phenyl terephthalate?
The molecular formula of Methyl phenyl terephthalate is C15H12O4.
What is the molecular weight of Methyl phenyl terephthalate?
The molecular weight of Methyl phenyl terephthalate is 256.07 g/mol.
Where can I buy Methyl phenyl terephthalate?
You can request a quote for Methyl phenyl terephthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl phenyl terephthalate?
Yes, KEHONG BIO provides custom synthesis services for Methyl phenyl terephthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.