2-(4-Bromo-3-methylphenoxy)-1-(morpholin-4-yl)ethanone
TL;DR: 2-(4-Bromo-3-methylphenoxy)-1-(morpholin-4-yl)ethanone (CAS 331436-07-8) is a chemical compound with molecular formula C13H16BrNO3 and molecular weight 313.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromo-3-methylphenoxy)-1-morpholin-4-ylethanone
Also Known As: BAS 00408150, 2-(4-bromo-3-methylphenoxy)-1-(morpholin-4-yl)ethanone, 2-(4-bromo-3-methylphenoxy)-1-morpholin-4-ylethanone, 2-(4-Bromo-3-methyl-phenoxy)-1-morpholin-4-yl-ethanone, 2-(4-bromo-3-methylphenoxy)-1-(morpholin-4-yl)ethan-1-one
| Molecular Formula | C13H16BrNO3 |
|---|---|
| Molecular Weight | 313.03 g/mol |
| LogP | 1.99512 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.03137 |
| Heavy Atoms | 18 |
| Complexity | 430.24457 |
Chemical Identifiers
| CAS Number | 331436-07-8 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)OCC(=O)N2CCOCC2)Br |
Product Overview
2-(4-Bromo-3-methylphenoxy)-1-(morpholin-4-yl)ethanone (CAS 331436-07-8), with molecular formula C13H16BrNO3 and molecular weight 313.03 g/mol. IUPAC: 2-(4-bromo-3-methylphenoxy)-1-morpholin-4-ylethanone.
Chemical Property Profile of 2-(4-Bromo-3-methylphenoxy)-1-(morpholin-4-yl)ethanone
Property Insights of 2-(4-Bromo-3-methylphenoxy)-1-(morpholin-4-yl)ethanone
The XLogP value of 1.99512 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Bromo-3-methylphenoxy)-1-(morpholin-4-yl)ethanone. With a topological polar surface area (TPSA) of 38.77 Ų, 2-(4-Bromo-3-methylphenoxy)-1-(morpholin-4-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Bromo-3-methylphenoxy)-1-(morpholin-4-yl)ethanone has 0 hydrogen bond donor(s) and 3 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 2-(4-Bromo-3-methylphenoxy)-1-(morpholin-4-yl)ethanone?
The CAS number of 2-(4-Bromo-3-methylphenoxy)-1-(morpholin-4-yl)ethanone is 331436-07-8.
What is the molecular formula of 2-(4-Bromo-3-methylphenoxy)-1-(morpholin-4-yl)ethanone?
The molecular formula of 2-(4-Bromo-3-methylphenoxy)-1-(morpholin-4-yl)ethanone is C13H16BrNO3.
What is the molecular weight of 2-(4-Bromo-3-methylphenoxy)-1-(morpholin-4-yl)ethanone?
The molecular weight of 2-(4-Bromo-3-methylphenoxy)-1-(morpholin-4-yl)ethanone is 313.03 g/mol.
Where can I buy 2-(4-Bromo-3-methylphenoxy)-1-(morpholin-4-yl)ethanone?
You can request a quote for 2-(4-Bromo-3-methylphenoxy)-1-(morpholin-4-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Bromo-3-methylphenoxy)-1-(morpholin-4-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Bromo-3-methylphenoxy)-1-(morpholin-4-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.