Butyl anthranilate
TL;DR: Butyl anthranilate (CAS 7756-96-9) is a chemical compound with molecular formula C11H15NO2 and molecular weight 193.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 2-aminobenzoate
Also Known As: BUTYL ANTHRANILATE, Butyl 2-aminobenzoate, n-Butyl anthranilate, Butyl O-aminobenzoate, n-Butyl o-aminobenzoate
| Molecular Formula | C11H15NO2 |
|---|---|
| Molecular Weight | 193.11 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 193.11028 |
| Heavy Atoms | 14 |
| Complexity | 182.0 |
| Melting Point | less than 0.0 °C |
| Boiling Point | 182.2 °C at 760 mmHg |
| Density | 1.067-1.073 |
| Solubility | Insoluble (NTP, 1992) |
| Refractive Index | 1.539-1.545 |
Chemical Identifiers
| CAS Number | 7756-96-9 |
|---|---|
| SMILES | CCCCOC(=O)C1=CC=CC=C1N |
| InChIKey | HUIYGGQINIVDNW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butyl anthranilate (CAS 7756-96-9), with molecular formula C11H15NO2 and molecular weight 193.11 g/mol. IUPAC: butyl 2-aminobenzoate.
Chemical Property Profile of Butyl anthranilate
Property Insights of Butyl anthranilate
The XLogP value of 3.5 indicates that Butyl 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, Butyl anthranilate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl 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 Butyl anthranilate?
The CAS number of Butyl anthranilate is 7756-96-9.
What is the molecular formula of Butyl anthranilate?
The molecular formula of Butyl anthranilate is C11H15NO2.
What is the molecular weight of Butyl anthranilate?
The molecular weight of Butyl anthranilate is 193.11 g/mol.
Where can I buy Butyl anthranilate?
You can request a quote for Butyl anthranilate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl anthranilate?
Yes, KEHONG BIO provides custom synthesis services for Butyl anthranilate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.