Cyclopropanecarboxylic acid, 4-nitrophenyl ester
TL;DR: Cyclopropanecarboxylic acid, 4-nitrophenyl ester (CAS 26050-99-7) is a chemical compound with molecular formula C10H9NO4 and molecular weight 207.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl) cyclopropanecarboxylate
Also Known As: 4-nitrophenyl cyclopropanecarboxylate, Cyclopropanecarboxylic acid, 4-nitrophenyl ester, (4-nitrophenyl) cyclopropanecarboxylate, Cyclopropanecarboxylic acid 4-nitrophenyl ester
| Molecular Formula | C10H9NO4 |
|---|---|
| Molecular Weight | 207.05 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 207.05316 |
| Heavy Atoms | 15 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 26050-99-7 |
|---|---|
| SMILES | C1CC1C(=O)OC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | KYHAMGAANHSNPQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclopropanecarboxylic acid, 4-nitrophenyl ester (CAS 26050-99-7), with molecular formula C10H9NO4 and molecular weight 207.05 g/mol. IUPAC: (4-nitrophenyl) cyclopropanecarboxylate.
Chemical Property Profile of Cyclopropanecarboxylic acid, 4-nitrophenyl ester
Property Insights of Cyclopropanecarboxylic acid, 4-nitrophenyl ester
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclopropanecarboxylic acid, 4-nitrophenyl ester. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Cyclopropanecarboxylic acid, 4-nitrophenyl ester. Following Lipinski's Rule of Five, Cyclopropanecarboxylic acid, 4-nitrophenyl 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 Cyclopropanecarboxylic acid, 4-nitrophenyl ester?
The CAS number of Cyclopropanecarboxylic acid, 4-nitrophenyl ester is 26050-99-7.
What is the molecular formula of Cyclopropanecarboxylic acid, 4-nitrophenyl ester?
The molecular formula of Cyclopropanecarboxylic acid, 4-nitrophenyl ester is C10H9NO4.
What is the molecular weight of Cyclopropanecarboxylic acid, 4-nitrophenyl ester?
The molecular weight of Cyclopropanecarboxylic acid, 4-nitrophenyl ester is 207.05 g/mol.
Where can I buy Cyclopropanecarboxylic acid, 4-nitrophenyl ester?
You can request a quote for Cyclopropanecarboxylic acid, 4-nitrophenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopropanecarboxylic acid, 4-nitrophenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Cyclopropanecarboxylic acid, 4-nitrophenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.