Acetic acid, (p-nitrophenyl)-, 2-fluoroethyl ester
TL;DR: Acetic acid, (p-nitrophenyl)-, 2-fluoroethyl ester (CAS 4242-30-2) is a chemical compound with molecular formula C10H10FNO4 and molecular weight 227.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-fluoroethyl 2-(4-nitrophenyl)acetate
Also Known As: 2-Fluoroethyl (4-nitrophenyl)acetate, (p-Nitrophenyl)acetic acid 2-fluoroethyl ester, 2-fluoroethyl 2-(4-nitrophenyl)acetate, ACETIC ACID, (p-NITROPHENYL)-, 2-FLUOROETHYL ESTER, BRN 2979805
| Molecular Formula | C10H10FNO4 |
|---|---|
| Molecular Weight | 227.06 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 227.05939 |
| Heavy Atoms | 16 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 4242-30-2 |
|---|---|
| SMILES | C1=CC(=CC=C1CC(=O)OCCF)[N+](=O)[O-] |
| InChIKey | GTCNCFMJBMQOJT-UHFFFAOYSA-N |
Product Overview
Acetic acid, (p-nitrophenyl)-, 2-fluoroethyl ester (CAS 4242-30-2), with molecular formula C10H10FNO4 and molecular weight 227.06 g/mol. IUPAC: 2-fluoroethyl 2-(4-nitrophenyl)acetate.
Chemical Property Profile of Acetic acid, (p-nitrophenyl)-, 2-fluoroethyl ester
Property Insights of Acetic acid, (p-nitrophenyl)-, 2-fluoroethyl ester
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, (p-nitrophenyl)-, 2-fluoroethyl ester. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, (p-nitrophenyl)-, 2-fluoroethyl ester. Following Lipinski's Rule of Five, Acetic acid, (p-nitrophenyl)-, 2-fluoroethyl ester has 0 hydrogen bond donor(s) and 5 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 Acetic acid, (p-nitrophenyl)-, 2-fluoroethyl ester?
The CAS number of Acetic acid, (p-nitrophenyl)-, 2-fluoroethyl ester is 4242-30-2.
What is the molecular formula of Acetic acid, (p-nitrophenyl)-, 2-fluoroethyl ester?
The molecular formula of Acetic acid, (p-nitrophenyl)-, 2-fluoroethyl ester is C10H10FNO4.
What is the molecular weight of Acetic acid, (p-nitrophenyl)-, 2-fluoroethyl ester?
The molecular weight of Acetic acid, (p-nitrophenyl)-, 2-fluoroethyl ester is 227.06 g/mol.
Where can I buy Acetic acid, (p-nitrophenyl)-, 2-fluoroethyl ester?
You can request a quote for Acetic acid, (p-nitrophenyl)-, 2-fluoroethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, (p-nitrophenyl)-, 2-fluoroethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, (p-nitrophenyl)-, 2-fluoroethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.