Formic acid, 4-methylphenyl ester
TL;DR: Formic acid, 4-methylphenyl ester (CAS 1864-97-7) is a chemical compound with molecular formula C8H8O2 and molecular weight 136.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methylphenyl) formate
Also Known As: p-Cresyl formate, 4-Methylphenyl formate, (4-methylphenyl) formate, p-tolyl formate, Formic acid, 4-methylphenyl ester
| Molecular Formula | C8H8O2 |
|---|---|
| Molecular Weight | 136.05 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 136.05243 |
| Heavy Atoms | 10 |
| Complexity | 104.0 |
Chemical Identifiers
| CAS Number | 1864-97-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OC=O |
| InChIKey | NEIANUMOAXBNRT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Formic acid, 4-methylphenyl ester (CAS 1864-97-7), with molecular formula C8H8O2 and molecular weight 136.05 g/mol. IUPAC: (4-methylphenyl) formate.
Chemical Property Profile of Formic acid, 4-methylphenyl ester
Property Insights of Formic acid, 4-methylphenyl ester
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Formic acid, 4-methylphenyl ester. With a topological polar surface area (TPSA) of 26.3 Ų, Formic acid, 4-methylphenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Formic acid, 4-methylphenyl ester 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 Formic acid, 4-methylphenyl ester?
The CAS number of Formic acid, 4-methylphenyl ester is 1864-97-7.
What is the molecular formula of Formic acid, 4-methylphenyl ester?
The molecular formula of Formic acid, 4-methylphenyl ester is C8H8O2.
What is the molecular weight of Formic acid, 4-methylphenyl ester?
The molecular weight of Formic acid, 4-methylphenyl ester is 136.05 g/mol.
Where can I buy Formic acid, 4-methylphenyl ester?
You can request a quote for Formic acid, 4-methylphenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Formic acid, 4-methylphenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Formic acid, 4-methylphenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.