Benzoic acid, 3-amino-4-chloro-, hexadecyl ester
TL;DR: Benzoic acid, 3-amino-4-chloro-, hexadecyl ester (CAS 143269-74-3) is a chemical compound with molecular formula C23H38ClNO2 and molecular weight 395.2591 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
hexadecyl 3-amino-4-chlorobenzoate
Also Known As: hexadecyl 3-amino-4-chlorobenzoate, 3-amino-4-chlorobenzoic acid hexadecyl ester, Hexadecyl 3-amino-4-chloro-benzoate, hexadecyl3-amino-4-chlorobenzoate, Benzoic acid, 3-amino-4-chloro-, hexadecyl ester
Technical Specifications
| Molecular Formula | C23H38ClNO2 |
| Molecular Weight | 395.2591 g/mol |
| XLogP | 9.5 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 17 |
| Exact Mass | 395.2591 Da |
| Heavy Atoms | 27 |
| Complexity | 364.0 |
| SMILES | CCCCCCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)Cl)N |
| InChIKey | WZPMUDCUMKEHSE-UHFFFAOYSA-N |
Chemical Property Profile of Benzoic acid, 3-amino-4-chloro-, hexadecyl ester
Property Insights of Benzoic acid, 3-amino-4-chloro-, hexadecyl ester
The XLogP value of 9.5 indicates that Benzoic acid, 3-amino-4-chloro-, hexadecyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.3 Ų, Benzoic acid, 3-amino-4-chloro-, hexadecyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 3-amino-4-chloro-, hexadecyl ester has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Benzoic acid, 3-amino-4-chloro-, hexadecyl ester?
The CAS number of Benzoic acid, 3-amino-4-chloro-, hexadecyl ester is 143269-74-3.
What is the molecular formula of Benzoic acid, 3-amino-4-chloro-, hexadecyl ester?
The molecular formula of Benzoic acid, 3-amino-4-chloro-, hexadecyl ester is C23H38ClNO2.
What is the molecular weight of Benzoic acid, 3-amino-4-chloro-, hexadecyl ester?
The molecular weight of Benzoic acid, 3-amino-4-chloro-, hexadecyl ester is 395.2591 g/mol.
Where can I buy Benzoic acid, 3-amino-4-chloro-, hexadecyl ester?
You can request a quote for Benzoic acid, 3-amino-4-chloro-, hexadecyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzoic acid, 3-amino-4-chloro-, hexadecyl ester?
Yes, CoreyChem provides custom synthesis services for Benzoic acid, 3-amino-4-chloro-, hexadecyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.