Methyl 4-((cis-2,6-dimethylmorpholin-4-yl)methyl)benzoate
TL;DR: Methyl 4-((cis-2,6-dimethylmorpholin-4-yl)methyl)benzoate (CAS 1335220-64-8) is a chemical compound with molecular formula C15H21NO3 and molecular weight 263.15213 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-[[(2S,6R)-2,6-dimethylmorpholin-4-yl]methyl]benzoate
Also Known As: methyl 4-{[cis-2,6-dimethylmorpholin-4-yl]methyl}benzoate, methylcisdimethylmorpholinylmethylbenzoate, methyl 4-{[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl}benzoate, methyl 4-[[(2S,6R)-2,6-dimethylmorpholin-4-yl]methyl]benzoate, Methyl 4-[(2,6-dimethylmorpholin-4-yl)methyl]benzoate
Technical Specifications
| Molecular Formula | C15H21NO3 |
| Molecular Weight | 263.15213 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 263.15213 Da |
| Heavy Atoms | 19 |
| Complexity | 290.0 |
| SMILES | C[C@@H]1CN(C[C@@H](O1)C)CC2=CC=C(C=C2)C(=O)OC |
| InChIKey | RUBXNPWHLYVIKR-TXEJJXNPSA-N |
Chemical Property Profile of Methyl 4-((cis-2,6-dimethylmorpholin-4-yl)methyl)benzoate
Property Insights of Methyl 4-((cis-2,6-dimethylmorpholin-4-yl)methyl)benzoate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-((cis-2,6-dimethylmorpholin-4-yl)methyl)benzoate. With a topological polar surface area (TPSA) of 38.8 Ų, Methyl 4-((cis-2,6-dimethylmorpholin-4-yl)methyl)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-((cis-2,6-dimethylmorpholin-4-yl)methyl)benzoate 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
What is the CAS number of Methyl 4-((cis-2,6-dimethylmorpholin-4-yl)methyl)benzoate?
The CAS number of Methyl 4-((cis-2,6-dimethylmorpholin-4-yl)methyl)benzoate is 1335220-64-8.
What is the molecular formula of Methyl 4-((cis-2,6-dimethylmorpholin-4-yl)methyl)benzoate?
The molecular formula of Methyl 4-((cis-2,6-dimethylmorpholin-4-yl)methyl)benzoate is C15H21NO3.
What is the molecular weight of Methyl 4-((cis-2,6-dimethylmorpholin-4-yl)methyl)benzoate?
The molecular weight of Methyl 4-((cis-2,6-dimethylmorpholin-4-yl)methyl)benzoate is 263.15213 g/mol.
Where can I buy Methyl 4-((cis-2,6-dimethylmorpholin-4-yl)methyl)benzoate?
You can request a quote for Methyl 4-((cis-2,6-dimethylmorpholin-4-yl)methyl)benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 4-((cis-2,6-dimethylmorpholin-4-yl)methyl)benzoate?
Yes, CoreyChem provides custom synthesis services for Methyl 4-((cis-2,6-dimethylmorpholin-4-yl)methyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.