RefChem:345098
TL;DR: RefChem:345098 (CAS 75264-55-0) is a chemical compound with molecular formula C14H19Cl2NO3 and molecular weight 319.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(7-chloro-6-prop-2-enyl-2,3-dihydro-1,4-benzodioxin-5-yl)oxy]ethyl-methylazanium chloride
Also Known As: Ethylamine, 2-((6-allyl-7-chloro-1,4-benzodioxan-5-yl)oxy)-N-methyl-, hydrochloride, 7-Chloro-5-(2-methylaminoethoxy)-6-allylbenzo-1,4-dioxane hydrochloride, 2-((6-Allyl-7-chloro-1,4-benzodioxan-5-yl)oxy)-N-methylethylamine hydrochloride, 2-[(7-chloro-6-prop-2-enyl-2,3-dihydro-1,4-benzodioxin-5-yl)oxy]ethyl-methylazanium chloride, RefChem:345098
| Molecular Formula | C14H19Cl2NO3 |
|---|---|
| Molecular Weight | 319.07 g/mol |
| LogP | -1.58 |
| Topological Polar Surface Area | 44.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 319.0742 |
| Heavy Atoms | 20 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 75264-55-0 |
|---|---|
| SMILES | C[NH2+]CCOC1=C2C(=CC(=C1CC=C)Cl)OCCO2.[Cl-] |
| InChIKey | BFUNPYYSLJNXQX-UHFFFAOYSA-N |
Product Overview
RefChem:345098 (CAS 75264-55-0), with molecular formula C14H19Cl2NO3 and molecular weight 319.07 g/mol. IUPAC: 2-[(7-chloro-6-prop-2-enyl-2,3-dihydro-1,4-benzodioxin-5-yl)oxy]ethyl-methylazanium chloride.
Chemical Property Profile of RefChem:345098
Property Insights of RefChem:345098
The XLogP value of -1.58 indicates that RefChem:345098 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:345098 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:345098 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
Frequently Asked Questions
What is the CAS number of RefChem:345098?
The CAS number of RefChem:345098 is 75264-55-0.
What is the molecular formula of RefChem:345098?
The molecular formula of RefChem:345098 is C14H19Cl2NO3.
What is the molecular weight of RefChem:345098?
The molecular weight of RefChem:345098 is 319.07 g/mol.
Where can I buy RefChem:345098?
You can request a quote for RefChem:345098 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:345098?
Yes, KEHONG BIO provides custom synthesis services for RefChem:345098 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.