Heptyl 2-aminobenzoate
TL;DR: Heptyl 2-aminobenzoate (CAS 18189-06-5) is a chemical compound with molecular formula C14H21NO2 and molecular weight 235.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
heptyl 2-aminobenzoate
Also Known As: Heptyl 2-aminobenzoate, 2-Aminobenzoic acid heptyl ester, 2-amino-benzoic acid heptyl ester, Benzoic acid, 2-amino-, heptyl ester
| Molecular Formula | C14H21NO2 |
|---|---|
| Molecular Weight | 235.16 g/mol |
| LogP | 3.396 |
| Topological Polar Surface Area | 52.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 235.15723 |
| Heavy Atoms | 17 |
| Complexity | 349.83038 |
Chemical Identifiers
| CAS Number | 18189-06-5 |
|---|---|
| SMILES | CCCCCCCOC(=O)C1=CC=CC=C1N |
Product Overview
Heptyl 2-aminobenzoate (CAS 18189-06-5), with molecular formula C14H21NO2 and molecular weight 235.16 g/mol. IUPAC: heptyl 2-aminobenzoate.
Chemical Property Profile of Heptyl 2-aminobenzoate
Property Insights of Heptyl 2-aminobenzoate
The XLogP value of 3.396 indicates that Heptyl 2-aminobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.32 Ų, Heptyl 2-aminobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptyl 2-aminobenzoate 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 Heptyl 2-aminobenzoate?
The CAS number of Heptyl 2-aminobenzoate is 18189-06-5.
What is the molecular formula of Heptyl 2-aminobenzoate?
The molecular formula of Heptyl 2-aminobenzoate is C14H21NO2.
What is the molecular weight of Heptyl 2-aminobenzoate?
The molecular weight of Heptyl 2-aminobenzoate is 235.16 g/mol.
Where can I buy Heptyl 2-aminobenzoate?
You can request a quote for Heptyl 2-aminobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heptyl 2-aminobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Heptyl 2-aminobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.