1-(4-Bromophenyl)-2-morpholinoethanone
TL;DR: 1-(4-Bromophenyl)-2-morpholinoethanone (CAS 349428-85-9) is a chemical compound with molecular formula C12H14BrNO2 and molecular weight 283.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromophenyl)-2-morpholin-4-ylethanone
Also Known As: 1-(4-Bromophenyl)-2-morpholinoethanone, 1-(4-bromophenyl)-2-morpholin-4-ylethanone, 1-(4-bromophenyl)-2-(morpholin-4-yl)ethanone, 2-(4-Bromophenyl)-1-morpholinoethanone, 1-(4-bromophenyl)-2-morpholino-ethanone
| Molecular Formula | C12H14BrNO2 |
|---|---|
| Molecular Weight | 283.02 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.02078 |
| Heavy Atoms | 16 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 349428-85-9 |
|---|---|
| SMILES | C1COCCN1CC(=O)C2=CC=C(C=C2)Br |
| InChIKey | RQLYWWGGZRDCIL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-Bromophenyl)-2-morpholinoethanone (CAS 349428-85-9), with molecular formula C12H14BrNO2 and molecular weight 283.02 g/mol. IUPAC: 1-(4-bromophenyl)-2-morpholin-4-ylethanone.
Chemical Property Profile of 1-(4-Bromophenyl)-2-morpholinoethanone
Property Insights of 1-(4-Bromophenyl)-2-morpholinoethanone
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Bromophenyl)-2-morpholinoethanone. With a topological polar surface area (TPSA) of 29.5 Ų, 1-(4-Bromophenyl)-2-morpholinoethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Bromophenyl)-2-morpholinoethanone 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 1-(4-Bromophenyl)-2-morpholinoethanone?
The CAS number of 1-(4-Bromophenyl)-2-morpholinoethanone is 349428-85-9.
What is the molecular formula of 1-(4-Bromophenyl)-2-morpholinoethanone?
The molecular formula of 1-(4-Bromophenyl)-2-morpholinoethanone is C12H14BrNO2.
What is the molecular weight of 1-(4-Bromophenyl)-2-morpholinoethanone?
The molecular weight of 1-(4-Bromophenyl)-2-morpholinoethanone is 283.02 g/mol.
Where can I buy 1-(4-Bromophenyl)-2-morpholinoethanone?
You can request a quote for 1-(4-Bromophenyl)-2-morpholinoethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Bromophenyl)-2-morpholinoethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Bromophenyl)-2-morpholinoethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.