RefChem:1079153
TL;DR: RefChem:1079153 (CAS 100311-09-9) is a chemical compound with molecular formula C18H31ClN2O3 and molecular weight 358.20233 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-amino-2-pentoxybenzoyl)oxyethyl-diethylazanium chloride
Also Known As: 4-Amino-2-pentyloxybenzoic acid 2-(diethylamino)ethyl ester hydrochloride, 2-(4-amino-2-pentoxybenzoyl)oxyethyl-diethylazanium chloride, 2-(4-amino-2-pentoxybenzoyl)oxyethyl-diethylazanium;chloride, Benzoic acid, 4-amino-2-pentyloxy-, 2-(diethylamino)ethyl ester, monohydrochloride, Benzoic acid,4-amino-2-(pentyloxy)-, 2-(diethylamino)ethyl ester, hydrochloride (1:1)
Technical Specifications
| Molecular Formula | C18H31ClN2O3 |
| Molecular Weight | 358.20233 g/mol |
| XLogP | -1.08 |
| Topological Polar Surface Area (TPSA) | 66.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 358.20233 Da |
| Heavy Atoms | 24 |
| Complexity | 321.0 |
| SMILES | CCCCCOC1=C(C=CC(=C1)N)C(=O)OCC[NH+](CC)CC.[Cl-] |
| InChIKey | LQXYIGKYIURAAX-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:1079153
Property Insights of RefChem:1079153
The XLogP value of -1.08 indicates that RefChem:1079153 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1079153. Following Lipinski's Rule of Five, RefChem:1079153 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:1079153?
The CAS number of RefChem:1079153 is 100311-09-9.
What is the molecular formula of RefChem:1079153?
The molecular formula of RefChem:1079153 is C18H31ClN2O3.
What is the molecular weight of RefChem:1079153?
The molecular weight of RefChem:1079153 is 358.20233 g/mol.
Where can I buy RefChem:1079153?
You can request a quote for RefChem:1079153 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1079153?
Yes, CoreyChem provides custom synthesis services for RefChem:1079153 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.