2-(亚乙基氨基)苯甲酸己酯
TL;DR: 2-(亚乙基氨基)苯甲酸己酯 (CAS 94850-02-9) is a chemical compound with molecular formula C15H21NO2 and molecular weight 247.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(亚乙基氨基)苯甲酸己酯
hexyl 2-(ethylideneamino)benzoate
Also Known As: Hexyl 2-(ethylideneamino)benzoate, hexyl2- benzoate, Benzoic acid, 2-(ethylideneamino)-, hexyl ester, hexyl 2 - (ethylideneamino)benzoate, hexyl 2-[(1e)-ethylideneamino]benzoate
| Molecular Formula | C15H21NO2 |
|---|---|
| Molecular Weight | 247.16 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 247.15723 |
| Heavy Atoms | 18 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 94850-02-9 |
|---|---|
| SMILES | CCCCCCOC(=O)C1=CC=CC=C1N=CC |
| InChIKey | SLZBWFCFGYFQBU-UHFFFAOYSA-N |
Product Overview
2-(亚乙基氨基)苯甲酸己酯 (CAS 94850-02-9), with molecular formula C15H21NO2 and molecular weight 247.16 g/mol. IUPAC: hexyl 2-(ethylideneamino)benzoate.
Chemical Property Profile of 2-(亚乙基氨基)苯甲酸己酯
Property Insights of 2-(亚乙基氨基)苯甲酸己酯
The XLogP value of 5.2 indicates that 2-(亚乙基氨基)苯甲酸己酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.7 Ų, 2-(亚乙基氨基)苯甲酸己酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(亚乙基氨基)苯甲酸己酯 has 0 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 2-(亚乙基氨基)苯甲酸己酯?
The CAS number of 2-(亚乙基氨基)苯甲酸己酯 is 94850-02-9.
What is the molecular formula of 2-(亚乙基氨基)苯甲酸己酯?
The molecular formula of 2-(亚乙基氨基)苯甲酸己酯 is C15H21NO2.
What is the molecular weight of 2-(亚乙基氨基)苯甲酸己酯?
The molecular weight of 2-(亚乙基氨基)苯甲酸己酯 is 247.16 g/mol.
Where can I buy 2-(亚乙基氨基)苯甲酸己酯?
You can request a quote for 2-(亚乙基氨基)苯甲酸己酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(亚乙基氨基)苯甲酸己酯?
Yes, KEHONG BIO provides custom synthesis services for 2-(亚乙基氨基)苯甲酸己酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.