(2R,6S)-2,6-Dimethyl-4-(4-nitrophenyl)morpholine
TL;DR: (2R,6S)-2,6-Dimethyl-4-(4-nitrophenyl)morpholine (CAS 700804-18-8) is a chemical compound with molecular formula C12H16N2O3 and molecular weight 236.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,6R)-2,6-dimethyl-4-(4-nitrophenyl)morpholine
Also Known As: (2R,6S)-2,6-Dimethyl-4-(4-nitrophenyl)morpholine, BAS 01053729, (2S,6R)-2,6-dimethyl-4-(4-nitrophenyl)morpholine, 1-(Cis-2,6-dimethylmorpholino)-4-nitrobenzene, cis-2,6-dimethyl-4-(4-nitrophenyl)morpholine
| Molecular Formula | C12H16N2O3 |
|---|---|
| Molecular Weight | 236.12 g/mol |
| LogP | 2.2084 |
| Topological Polar Surface Area | 55.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.11609 |
| Heavy Atoms | 17 |
| Complexity | 394.7167 |
Chemical Identifiers
| CAS Number | 700804-18-8 |
|---|---|
| SMILES | C[C@@H]1CN(C[C@@H](O1)C)C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
(2R,6S)-2,6-Dimethyl-4-(4-nitrophenyl)morpholine (CAS 700804-18-8), with molecular formula C12H16N2O3 and molecular weight 236.12 g/mol. IUPAC: (2S,6R)-2,6-dimethyl-4-(4-nitrophenyl)morpholine.
Chemical Property Profile of (2R,6S)-2,6-Dimethyl-4-(4-nitrophenyl)morpholine
Property Insights of (2R,6S)-2,6-Dimethyl-4-(4-nitrophenyl)morpholine
The XLogP value of 2.2084 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2R,6S)-2,6-Dimethyl-4-(4-nitrophenyl)morpholine. With a topological polar surface area (TPSA) of 55.61 Ų, (2R,6S)-2,6-Dimethyl-4-(4-nitrophenyl)morpholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2R,6S)-2,6-Dimethyl-4-(4-nitrophenyl)morpholine 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 (2R,6S)-2,6-Dimethyl-4-(4-nitrophenyl)morpholine?
The CAS number of (2R,6S)-2,6-Dimethyl-4-(4-nitrophenyl)morpholine is 700804-18-8.
What is the molecular formula of (2R,6S)-2,6-Dimethyl-4-(4-nitrophenyl)morpholine?
The molecular formula of (2R,6S)-2,6-Dimethyl-4-(4-nitrophenyl)morpholine is C12H16N2O3.
What is the molecular weight of (2R,6S)-2,6-Dimethyl-4-(4-nitrophenyl)morpholine?
The molecular weight of (2R,6S)-2,6-Dimethyl-4-(4-nitrophenyl)morpholine is 236.12 g/mol.
Where can I buy (2R,6S)-2,6-Dimethyl-4-(4-nitrophenyl)morpholine?
You can request a quote for (2R,6S)-2,6-Dimethyl-4-(4-nitrophenyl)morpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2R,6S)-2,6-Dimethyl-4-(4-nitrophenyl)morpholine?
Yes, KEHONG BIO provides custom synthesis services for (2R,6S)-2,6-Dimethyl-4-(4-nitrophenyl)morpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.