3-Methyl-4-(methylethyl)phenyl morpholine-4-carboxylate
TL;DR: 3-Methyl-4-(methylethyl)phenyl morpholine-4-carboxylate (CAS 314262-13-0) is a chemical compound with molecular formula C15H21NO3 and molecular weight 263.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-methyl-4-propan-2-ylphenyl) morpholine-4-carboxylate
Also Known As: BAS 05022634, 3-methyl-4-(methylethyl)phenyl morpholine-4-carboxylate, (3-methyl-4-propan-2-ylphenyl) morpholine-4-carboxylate, Morpholine-4-carboxylic acid 4-isopropyl-3-methyl-phenyl ester
| Molecular Formula | C15H21NO3 |
|---|---|
| Molecular Weight | 263.15 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 263.15213 |
| Heavy Atoms | 19 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 314262-13-0 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)OC(=O)N2CCOCC2)C(C)C |
| InChIKey | OTGPEVVIKDVQDD-UHFFFAOYSA-N |
Product Overview
3-Methyl-4-(methylethyl)phenyl morpholine-4-carboxylate (CAS 314262-13-0), with molecular formula C15H21NO3 and molecular weight 263.15 g/mol. IUPAC: (3-methyl-4-propan-2-ylphenyl) morpholine-4-carboxylate.
Chemical Property Profile of 3-Methyl-4-(methylethyl)phenyl morpholine-4-carboxylate
Property Insights of 3-Methyl-4-(methylethyl)phenyl morpholine-4-carboxylate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-4-(methylethyl)phenyl morpholine-4-carboxylate. With a topological polar surface area (TPSA) of 38.8 Ų, 3-Methyl-4-(methylethyl)phenyl morpholine-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-4-(methylethyl)phenyl 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 3-Methyl-4-(methylethyl)phenyl morpholine-4-carboxylate?
The CAS number of 3-Methyl-4-(methylethyl)phenyl morpholine-4-carboxylate is 314262-13-0.
What is the molecular formula of 3-Methyl-4-(methylethyl)phenyl morpholine-4-carboxylate?
The molecular formula of 3-Methyl-4-(methylethyl)phenyl morpholine-4-carboxylate is C15H21NO3.
What is the molecular weight of 3-Methyl-4-(methylethyl)phenyl morpholine-4-carboxylate?
The molecular weight of 3-Methyl-4-(methylethyl)phenyl morpholine-4-carboxylate is 263.15 g/mol.
Where can I buy 3-Methyl-4-(methylethyl)phenyl morpholine-4-carboxylate?
You can request a quote for 3-Methyl-4-(methylethyl)phenyl 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 3-Methyl-4-(methylethyl)phenyl morpholine-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-4-(methylethyl)phenyl morpholine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.