Pentyl 2-(methylamino)benzoate
TL;DR: Pentyl 2-(methylamino)benzoate (CAS 15236-37-0) is a chemical compound with molecular formula C13H19NO2 and molecular weight 221.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentyl 2-(methylamino)benzoate
Also Known As: Pentyl 2-(methylamino)benzoate, 2-Methylaminobenzoic acid pentyl ester, Pentyl 2-(methylamino)benzoate #, N-Methylanthanilic acid pentyl ester, Anthranilic acid, N-methyl-, pentyl ester
| Molecular Formula | C13H19NO2 |
|---|---|
| Molecular Weight | 221.14 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 221.14159 |
| Heavy Atoms | 16 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 15236-37-0 |
|---|---|
| SMILES | CCCCCOC(=O)C1=CC=CC=C1NC |
| InChIKey | OMFYLKAQOUNQOE-UHFFFAOYSA-N |
Product Overview
Pentyl 2-(methylamino)benzoate (CAS 15236-37-0), with molecular formula C13H19NO2 and molecular weight 221.14 g/mol. IUPAC: pentyl 2-(methylamino)benzoate.
Chemical Property Profile of Pentyl 2-(methylamino)benzoate
Property Insights of Pentyl 2-(methylamino)benzoate
The XLogP value of 5.5 indicates that Pentyl 2-(methylamino)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Pentyl 2-(methylamino)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentyl 2-(methylamino)benzoate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pentyl 2-(methylamino)benzoate?
The CAS number of Pentyl 2-(methylamino)benzoate is 15236-37-0.
What is the molecular formula of Pentyl 2-(methylamino)benzoate?
The molecular formula of Pentyl 2-(methylamino)benzoate is C13H19NO2.
What is the molecular weight of Pentyl 2-(methylamino)benzoate?
The molecular weight of Pentyl 2-(methylamino)benzoate is 221.14 g/mol.
Where can I buy Pentyl 2-(methylamino)benzoate?
You can request a quote for Pentyl 2-(methylamino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentyl 2-(methylamino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Pentyl 2-(methylamino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.