Cyclohexyl anthranilate
TL;DR: Cyclohexyl anthranilate (CAS 7779-16-0) is a chemical compound with molecular formula C13H17NO2 and molecular weight 219.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclohexyl 2-aminobenzoate
Also Known As: CYCLOHEXYL ANTHRANILATE, Cyclohexyl 2-aminobenzoate, Anthranilic acid, cyclohexyl ester, FEMA No. 2350, Benzoic acid, 2-amino-, cyclohexyl ester
| Molecular Formula | C13H17NO2 |
|---|---|
| Molecular Weight | 219.13 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 219.12593 |
| Heavy Atoms | 16 |
| Complexity | 236.0 |
| Density | 1.117 at 18.9 °C |
| Solubility | less than 1 mg/mL at 73 °F (NTP, 1992) |
| Flash Point | greater than 104.4 °C |
| Refractive Index | 1.571-1.577 |
Chemical Identifiers
| CAS Number | 7779-16-0 |
|---|---|
| SMILES | C1CCC(CC1)OC(=O)C2=CC=CC=C2N |
| InChIKey | KFEZETDKFSMLMG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclohexyl anthranilate (CAS 7779-16-0), with molecular formula C13H17NO2 and molecular weight 219.13 g/mol. IUPAC: cyclohexyl 2-aminobenzoate.
Chemical Property Profile of Cyclohexyl anthranilate
Property Insights of Cyclohexyl anthranilate
The XLogP value of 3.7 indicates that Cyclohexyl anthranilate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.3 Ų, Cyclohexyl anthranilate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexyl anthranilate has 1 hydrogen bond donor(s) and 3 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 Cyclohexyl anthranilate?
The CAS number of Cyclohexyl anthranilate is 7779-16-0.
What is the molecular formula of Cyclohexyl anthranilate?
The molecular formula of Cyclohexyl anthranilate is C13H17NO2.
What is the molecular weight of Cyclohexyl anthranilate?
The molecular weight of Cyclohexyl anthranilate is 219.13 g/mol.
Where can I buy Cyclohexyl anthranilate?
You can request a quote for Cyclohexyl anthranilate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexyl anthranilate?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexyl anthranilate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.