(3-Methyl-4-nitrophenyl)(morpholin-4-yl)methanone
TL;DR: (3-Methyl-4-nitrophenyl)(morpholin-4-yl)methanone (CAS 309738-71-4) 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.
(3-methyl-4-nitrophenyl)-morpholin-4-ylmethanone
Also Known As: (3-methyl-4-nitrophenyl)(morpholin-4-yl)methanone, BAS 00785358, 4-(3-METHYL-4-NITROBENZOYL)MORPHOLINE, 3-methyl-4-nitrophenyl morpholin-4-yl ketone, (3-methyl-4-nitrophenyl)-morpholin-4-ylmethanone
| Molecular Formula | C12H14N2O4 |
|---|---|
| Molecular Weight | 250.10 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 75.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 250.09535 |
| Heavy Atoms | 18 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 309738-71-4 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C(=O)N2CCOCC2)[N+](=O)[O-] |
| InChIKey | SXKBDTPTTWBEJU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(3-Methyl-4-nitrophenyl)(morpholin-4-yl)methanone (CAS 309738-71-4), with molecular formula C12H14N2O4 and molecular weight 250.10 g/mol. IUPAC: (3-methyl-4-nitrophenyl)-morpholin-4-ylmethanone.
Chemical Property Profile of (3-Methyl-4-nitrophenyl)(morpholin-4-yl)methanone
Property Insights of (3-Methyl-4-nitrophenyl)(morpholin-4-yl)methanone
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Methyl-4-nitrophenyl)(morpholin-4-yl)methanone. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Methyl-4-nitrophenyl)(morpholin-4-yl)methanone. Following Lipinski's Rule of Five, (3-Methyl-4-nitrophenyl)(morpholin-4-yl)methanone has 0 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 (3-Methyl-4-nitrophenyl)(morpholin-4-yl)methanone?
The CAS number of (3-Methyl-4-nitrophenyl)(morpholin-4-yl)methanone is 309738-71-4.
What is the molecular formula of (3-Methyl-4-nitrophenyl)(morpholin-4-yl)methanone?
The molecular formula of (3-Methyl-4-nitrophenyl)(morpholin-4-yl)methanone is C12H14N2O4.
What is the molecular weight of (3-Methyl-4-nitrophenyl)(morpholin-4-yl)methanone?
The molecular weight of (3-Methyl-4-nitrophenyl)(morpholin-4-yl)methanone is 250.10 g/mol.
Where can I buy (3-Methyl-4-nitrophenyl)(morpholin-4-yl)methanone?
You can request a quote for (3-Methyl-4-nitrophenyl)(morpholin-4-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Methyl-4-nitrophenyl)(morpholin-4-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (3-Methyl-4-nitrophenyl)(morpholin-4-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.