3,5-Dimethylphenyl 4-morpholinecarboxylate
TL;DR: 3,5-Dimethylphenyl 4-morpholinecarboxylate (CAS 825608-26-2) is a chemical compound with molecular formula C13H17NO3 and molecular weight 235.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,5-dimethylphenyl) morpholine-4-carboxylate
Also Known As: 3,5-dimethylphenyl 4-morpholinecarboxylate, 3,5-xylyl 4-morpholinecarboxylate, (3,5-dimethylphenyl) morpholine-4-carboxylate, SDCCGMLS-0018137.P002, 3,5-dimethylphenyl morpholine-4-carboxylate
| Molecular Formula | C13H17NO3 |
|---|---|
| Molecular Weight | 235.12 g/mol |
| LogP | 2.13444 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 235.12085 |
| Heavy Atoms | 17 |
| Complexity | 390.87564 |
Chemical Identifiers
| CAS Number | 825608-26-2 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)OC(=O)N2CCOCC2)C |
Product Overview
3,5-Dimethylphenyl 4-morpholinecarboxylate (CAS 825608-26-2), with molecular formula C13H17NO3 and molecular weight 235.12 g/mol. IUPAC: (3,5-dimethylphenyl) morpholine-4-carboxylate.
Chemical Property Profile of 3,5-Dimethylphenyl 4-morpholinecarboxylate
Property Insights of 3,5-Dimethylphenyl 4-morpholinecarboxylate
The XLogP value of 2.13444 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dimethylphenyl 4-morpholinecarboxylate. With a topological polar surface area (TPSA) of 38.77 Ų, 3,5-Dimethylphenyl 4-morpholinecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dimethylphenyl 4-morpholinecarboxylate 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 3,5-Dimethylphenyl 4-morpholinecarboxylate?
The CAS number of 3,5-Dimethylphenyl 4-morpholinecarboxylate is 825608-26-2.
What is the molecular formula of 3,5-Dimethylphenyl 4-morpholinecarboxylate?
The molecular formula of 3,5-Dimethylphenyl 4-morpholinecarboxylate is C13H17NO3.
What is the molecular weight of 3,5-Dimethylphenyl 4-morpholinecarboxylate?
The molecular weight of 3,5-Dimethylphenyl 4-morpholinecarboxylate is 235.12 g/mol.
Where can I buy 3,5-Dimethylphenyl 4-morpholinecarboxylate?
You can request a quote for 3,5-Dimethylphenyl 4-morpholinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dimethylphenyl 4-morpholinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dimethylphenyl 4-morpholinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.