RefChem:345102
TL;DR: RefChem:345102 (CAS 101418-22-8) is a chemical compound with molecular formula C14H19Cl2NO3 and molecular weight 319.0742 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(6-chloro-8-prop-2-enyl-2,3-dihydro-1,4-benzodioxin-5-yl)oxy]ethyl-methylazanium chloride
Also Known As: Ethylamine, 2-((8-allyl-6-chloro-1,4-benzodioxan-5-yl)oxy)-N-methyl-, hydrochloride, 2-((8-Allyl-6-chloro-1,4-benzodioxan-5-yl)oxy)-N-methylethylamine hydrochloride, 2-[(6-chloro-8-prop-2-enyl-2,3-dihydro-1,4-benzodioxin-5-yl)oxy]ethyl-methylazanium chloride, 2-{[6-chloro-8-(prop-2-en-1-yl)-2,3-dihydro-1,4-benzodioxin-5-yl]oxy}-n-methylethanaminium chloride
Technical Specifications
| Molecular Formula | C14H19Cl2NO3 |
| Molecular Weight | 319.0742 g/mol |
| XLogP | -1.58 |
| Topological Polar Surface Area (TPSA) | 44.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 319.0742 Da |
| Heavy Atoms | 20 |
| Complexity | 290.0 |
| SMILES | C[NH2+]CCOC1=C(C=C(C2=C1OCCO2)CC=C)Cl.[Cl-] |
| InChIKey | DHXFVPRPTURRTB-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:345102
Property Insights of RefChem:345102
The XLogP value of -1.58 indicates that RefChem:345102 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 44.3 Ų, RefChem:345102 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:345102 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:345102?
The CAS number of RefChem:345102 is 101418-22-8.
What is the molecular formula of RefChem:345102?
The molecular formula of RefChem:345102 is C14H19Cl2NO3.
What is the molecular weight of RefChem:345102?
The molecular weight of RefChem:345102 is 319.0742 g/mol.
Where can I buy RefChem:345102?
You can request a quote for RefChem:345102 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:345102?
Yes, CoreyChem provides custom synthesis services for RefChem:345102 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.