2-Morpholin-4-yl-1-(4-nitrophenyl)ethanone
TL;DR: 2-Morpholin-4-yl-1-(4-nitrophenyl)ethanone (CAS 79378-15-7) is a chemical compound with molecular formula C12H14N2O4 and molecular weight 250.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-morpholin-4-yl-1-(4-nitrophenyl)ethanone
Also Known As: THP ether of phenylbenzyl alcohol, 2-morpholin-4-yl-1-(4-nitrophenyl)ethanone, 2-morpholino-1-(4-nitrophenyl)ethan-1-one, 1-(4-nitrophenyl)-2-morpholinylethanone, 2-morpholin-4-yl-1-(4-nitro-phenyl)-ethanone
| Molecular Formula | C12H14N2O4 |
|---|---|
| Molecular Weight | 250.10 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 75.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.09535 |
| Heavy Atoms | 18 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 79378-15-7 |
|---|---|
| SMILES | C1COCCN1CC(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | RIDJIJUABGPIDB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Morpholin-4-yl-1-(4-nitrophenyl)ethanone (CAS 79378-15-7), with molecular formula C12H14N2O4 and molecular weight 250.10 g/mol. IUPAC: 2-morpholin-4-yl-1-(4-nitrophenyl)ethanone.
Chemical Property Profile of 2-Morpholin-4-yl-1-(4-nitrophenyl)ethanone
Property Insights of 2-Morpholin-4-yl-1-(4-nitrophenyl)ethanone
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Morpholin-4-yl-1-(4-nitrophenyl)ethanone. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Morpholin-4-yl-1-(4-nitrophenyl)ethanone. Following Lipinski's Rule of Five, 2-Morpholin-4-yl-1-(4-nitrophenyl)ethanone has 0 hydrogen bond donor(s) and 5 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-Morpholin-4-yl-1-(4-nitrophenyl)ethanone?
The CAS number of 2-Morpholin-4-yl-1-(4-nitrophenyl)ethanone is 79378-15-7.
What is the molecular formula of 2-Morpholin-4-yl-1-(4-nitrophenyl)ethanone?
The molecular formula of 2-Morpholin-4-yl-1-(4-nitrophenyl)ethanone is C12H14N2O4.
What is the molecular weight of 2-Morpholin-4-yl-1-(4-nitrophenyl)ethanone?
The molecular weight of 2-Morpholin-4-yl-1-(4-nitrophenyl)ethanone is 250.10 g/mol.
Where can I buy 2-Morpholin-4-yl-1-(4-nitrophenyl)ethanone?
You can request a quote for 2-Morpholin-4-yl-1-(4-nitrophenyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Morpholin-4-yl-1-(4-nitrophenyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-Morpholin-4-yl-1-(4-nitrophenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.