Isononyl anthranilate
TL;DR: Isononyl anthranilate (CAS 49553-64-2) is a chemical compound with molecular formula C16H25NO2 and molecular weight 263.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyloctyl 2-aminobenzoate
Also Known As: Isononyl anthranilate, 7-methyloctyl 2-aminobenzoate, EINECS 256-366-9, Benzoic acid, 2-amino-, isononyl ester, Benzoic acid, 2-amino-,isononyl ester (9CI)
| Molecular Formula | C16H25NO2 |
|---|---|
| Molecular Weight | 263.19 g/mol |
| LogP | 4.0321 |
| Topological Polar Surface Area | 52.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 263.18854 |
| Heavy Atoms | 19 |
| Complexity | 388.09024 |
Chemical Identifiers
| CAS Number | 49553-64-2 |
|---|---|
| SMILES | CC(C)CCCCCCOC(=O)C1=CC=CC=C1N |
Product Overview
Isononyl anthranilate (CAS 49553-64-2), with molecular formula C16H25NO2 and molecular weight 263.19 g/mol. IUPAC: 7-methyloctyl 2-aminobenzoate.
Chemical Property Profile of Isononyl anthranilate
Property Insights of Isononyl anthranilate
The XLogP value of 4.0321 indicates that Isononyl anthranilate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.32 Ų, Isononyl anthranilate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isononyl 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 Isononyl anthranilate?
The CAS number of Isononyl anthranilate is 49553-64-2.
What is the molecular formula of Isononyl anthranilate?
The molecular formula of Isononyl anthranilate is C16H25NO2.
What is the molecular weight of Isononyl anthranilate?
The molecular weight of Isononyl anthranilate is 263.19 g/mol.
Where can I buy Isononyl anthranilate?
You can request a quote for Isononyl anthranilate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isononyl anthranilate?
Yes, KEHONG BIO provides custom synthesis services for Isononyl anthranilate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.