4-Aminobenzo-15-crown-5 hydrochloride
TL;DR: 4-Aminobenzo-15-crown-5 hydrochloride (CAS 111076-66-5) is a chemical compound with molecular formula C14H22ClNO5 and molecular weight 319.11865 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-amine;hydrochloride
Also Known As: 4-Aminobenzo-15-crown-5 hydrochloride, 2,3,5,6,8,9,11,12-Octahydrobenzo[b][1,4,7,10,13]pentaoxacyclopentadecin-15-amine hydrochloride, 4-Amino-benzo-15-crown-5,Hydrochloride, 4-Amino-benzo-15-crown-5, hydrochloride, 076A665
Technical Specifications
| Molecular Formula | C14H22ClNO5 |
| Molecular Weight | 319.11865 g/mol |
| XLogP | 1.5116 |
| Topological Polar Surface Area (TPSA) | 72.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 319.11865 Da |
| Heavy Atoms | 21 |
| Complexity | 254.0 |
| SMILES | C1COCCOC2=C(C=C(C=C2)N)OCCOCCO1.Cl |
| InChIKey | HZNFLCQAHYOUST-UHFFFAOYSA-N |
Chemical Property Profile of 4-Aminobenzo-15-crown-5 hydrochloride
Property Insights of 4-Aminobenzo-15-crown-5 hydrochloride
The XLogP value of 1.5116 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Aminobenzo-15-crown-5 hydrochloride. The TPSA of 72.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Aminobenzo-15-crown-5 hydrochloride. Following Lipinski's Rule of Five, 4-Aminobenzo-15-crown-5 hydrochloride has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Aminobenzo-15-crown-5 hydrochloride?
The CAS number of 4-Aminobenzo-15-crown-5 hydrochloride is 111076-66-5.
What is the molecular formula of 4-Aminobenzo-15-crown-5 hydrochloride?
The molecular formula of 4-Aminobenzo-15-crown-5 hydrochloride is C14H22ClNO5.
What is the molecular weight of 4-Aminobenzo-15-crown-5 hydrochloride?
The molecular weight of 4-Aminobenzo-15-crown-5 hydrochloride is 319.11865 g/mol.
Where can I buy 4-Aminobenzo-15-crown-5 hydrochloride?
You can request a quote for 4-Aminobenzo-15-crown-5 hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Aminobenzo-15-crown-5 hydrochloride?
Yes, CoreyChem provides custom synthesis services for 4-Aminobenzo-15-crown-5 hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.