Carbonic acid, p-fluorophenyl methyl ester
TL;DR: Carbonic acid, p-fluorophenyl methyl ester (CAS 1847-98-9) is a chemical compound with molecular formula C8H7FO3 and molecular weight 170.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-fluorophenyl) methyl carbonate
Also Known As: (4-fluorophenyl) methyl carbonate, 4-Fluorophenyl methyl carbonate, Carbonic acid methyl 4-fluorophenyl ester, 4-Fluorophenyl methyl carbonate #, Carbonic acid, 4-fluorophenyl methyl ester
| Molecular Formula | C8H7FO3 |
|---|---|
| Molecular Weight | 170.04 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 170.03792 |
| Heavy Atoms | 12 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 1847-98-9 |
|---|---|
| SMILES | COC(=O)OC1=CC=C(C=C1)F |
| InChIKey | AIFCAHCJHDKMPG-UHFFFAOYSA-N |
Product Overview
Carbonic acid, p-fluorophenyl methyl ester (CAS 1847-98-9), with molecular formula C8H7FO3 and molecular weight 170.04 g/mol. IUPAC: (4-fluorophenyl) methyl carbonate.
Chemical Property Profile of Carbonic acid, p-fluorophenyl methyl ester
Property Insights of Carbonic acid, p-fluorophenyl methyl ester
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbonic acid, p-fluorophenyl methyl ester. With a topological polar surface area (TPSA) of 35.5 Ų, Carbonic acid, p-fluorophenyl methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbonic acid, p-fluorophenyl methyl ester 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 Carbonic acid, p-fluorophenyl methyl ester?
The CAS number of Carbonic acid, p-fluorophenyl methyl ester is 1847-98-9.
What is the molecular formula of Carbonic acid, p-fluorophenyl methyl ester?
The molecular formula of Carbonic acid, p-fluorophenyl methyl ester is C8H7FO3.
What is the molecular weight of Carbonic acid, p-fluorophenyl methyl ester?
The molecular weight of Carbonic acid, p-fluorophenyl methyl ester is 170.04 g/mol.
Where can I buy Carbonic acid, p-fluorophenyl methyl ester?
You can request a quote for Carbonic acid, p-fluorophenyl methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbonic acid, p-fluorophenyl methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbonic acid, p-fluorophenyl methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.