RefChem:1053185
TL;DR: RefChem:1053185 (CAS 93638-04-1) is a chemical compound with molecular formula C18H22ClNO3 and molecular weight 335.1288 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-methoxyphenyl)propyl]azanium chloride
Also Known As: 1,4-Benzodioxin-6-propanamine, 2,3-dihydro-alpha-(4-methoxyphenyl)-, hydrochloride, alpha-(p-Methoxyphenyl)-1,4-benzodioxan-6-propylamine hydrochloride, 1,4-Benzodioxan-6-propylamine, alpha-(p-methoxyphenyl)-, hydrochloride, 2,3-Dihydro-alpha-(4-methoxyphenyl)-1,4-benzodioxin-6-propanamine hydrochloride, [3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-methoxyphenyl)propyl]azanium chloride
Technical Specifications
| Molecular Formula | C18H22ClNO3 |
| Molecular Weight | 335.1288 g/mol |
| XLogP | -0.61 |
| Topological Polar Surface Area (TPSA) | 55.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 335.1288 Da |
| Heavy Atoms | 23 |
| Complexity | 330.0 |
| SMILES | COC1=CC=C(C=C1)C(CCC2=CC3=C(C=C2)OCCO3)[NH3+].[Cl-] |
| InChIKey | YZSLDBDZJHBZPJ-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:1053185
Property Insights of RefChem:1053185
The XLogP value of -0.61 indicates that RefChem:1053185 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 55.3 Ų, RefChem:1053185 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1053185 has 1 hydrogen bond donor(s) and 4 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:1053185?
The CAS number of RefChem:1053185 is 93638-04-1.
What is the molecular formula of RefChem:1053185?
The molecular formula of RefChem:1053185 is C18H22ClNO3.
What is the molecular weight of RefChem:1053185?
The molecular weight of RefChem:1053185 is 335.1288 g/mol.
Where can I buy RefChem:1053185?
You can request a quote for RefChem:1053185 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1053185?
Yes, CoreyChem provides custom synthesis services for RefChem:1053185 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.