4-Chloro-3,5-dimethylphenyl morpholine-4-carboxylate
TL;DR: 4-Chloro-3,5-dimethylphenyl morpholine-4-carboxylate (CAS 701217-31-4) is a chemical compound with molecular formula C13H16ClNO3 and molecular weight 269.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chloro-3,5-dimethylphenyl) morpholine-4-carboxylate
Also Known As: 4-chloro-3,5-dimethylphenyl morpholine-4-carboxylate, 4-chloro-3,5-dimethylphenyl 4-morpholinecarboxylate, (4-chloro-3,5-dimethylphenyl) morpholine-4-carboxylate
| Molecular Formula | C13H16ClNO3 |
|---|---|
| Molecular Weight | 269.08 g/mol |
| LogP | 2.78784 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 269.08188 |
| Heavy Atoms | 18 |
| Complexity | 432.54474 |
Chemical Identifiers
| CAS Number | 701217-31-4 |
|---|---|
| SMILES | CC1=CC(=CC(=C1Cl)C)OC(=O)N2CCOCC2 |
Product Overview
4-Chloro-3,5-dimethylphenyl morpholine-4-carboxylate (CAS 701217-31-4), with molecular formula C13H16ClNO3 and molecular weight 269.08 g/mol. IUPAC: (4-chloro-3,5-dimethylphenyl) morpholine-4-carboxylate.
Chemical Property Profile of 4-Chloro-3,5-dimethylphenyl morpholine-4-carboxylate
Property Insights of 4-Chloro-3,5-dimethylphenyl morpholine-4-carboxylate
The XLogP value of 2.78784 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-3,5-dimethylphenyl morpholine-4-carboxylate. With a topological polar surface area (TPSA) of 38.77 Ų, 4-Chloro-3,5-dimethylphenyl morpholine-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-3,5-dimethylphenyl morpholine-4-carboxylate 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 4-Chloro-3,5-dimethylphenyl morpholine-4-carboxylate?
The CAS number of 4-Chloro-3,5-dimethylphenyl morpholine-4-carboxylate is 701217-31-4.
What is the molecular formula of 4-Chloro-3,5-dimethylphenyl morpholine-4-carboxylate?
The molecular formula of 4-Chloro-3,5-dimethylphenyl morpholine-4-carboxylate is C13H16ClNO3.
What is the molecular weight of 4-Chloro-3,5-dimethylphenyl morpholine-4-carboxylate?
The molecular weight of 4-Chloro-3,5-dimethylphenyl morpholine-4-carboxylate is 269.08 g/mol.
Where can I buy 4-Chloro-3,5-dimethylphenyl morpholine-4-carboxylate?
You can request a quote for 4-Chloro-3,5-dimethylphenyl morpholine-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-3,5-dimethylphenyl morpholine-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-3,5-dimethylphenyl morpholine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.