Methyl 5-amino-2-morpholinobenzoate
TL;DR: Methyl 5-amino-2-morpholinobenzoate (CAS 4031-84-9) 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.
methyl 5-amino-2-morpholin-4-ylbenzoate
Also Known As: Methyl 5-amino-2-morpholinobenzoate, Methyl 5-amino-2-morpholinobenzenecarboxylate, methyl 5-amino-2-(morpholin-4-yl)benzoate, methyl 5-amino-2-morpholin-4-ylbenzoate, Methyl 5-amino-2-morpholino-benzoate
| Molecular Formula | C12H16N2O3 |
|---|---|
| Molecular Weight | 236.12 g/mol |
| LogP | 0.892 |
| Topological Polar Surface Area | 64.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.11609 |
| Heavy Atoms | 17 |
| Complexity | 414.21182 |
Chemical Identifiers
| CAS Number | 4031-84-9 |
|---|---|
| SMILES | COC(=O)C1=C(C=CC(=C1)N)N2CCOCC2 |
Product Overview
Methyl 5-amino-2-morpholinobenzoate (CAS 4031-84-9), with molecular formula C12H16N2O3 and molecular weight 236.12 g/mol. IUPAC: methyl 5-amino-2-morpholin-4-ylbenzoate.
Chemical Property Profile of Methyl 5-amino-2-morpholinobenzoate
Property Insights of Methyl 5-amino-2-morpholinobenzoate
The XLogP value of 0.892 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 5-amino-2-morpholinobenzoate. The TPSA of 64.79 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 5-amino-2-morpholinobenzoate. Following Lipinski's Rule of Five, Methyl 5-amino-2-morpholinobenzoate has 1 hydrogen bond donor(s) and 5 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 Methyl 5-amino-2-morpholinobenzoate?
The CAS number of Methyl 5-amino-2-morpholinobenzoate is 4031-84-9.
What is the molecular formula of Methyl 5-amino-2-morpholinobenzoate?
The molecular formula of Methyl 5-amino-2-morpholinobenzoate is C12H16N2O3.
What is the molecular weight of Methyl 5-amino-2-morpholinobenzoate?
The molecular weight of Methyl 5-amino-2-morpholinobenzoate is 236.12 g/mol.
Where can I buy Methyl 5-amino-2-morpholinobenzoate?
You can request a quote for Methyl 5-amino-2-morpholinobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-amino-2-morpholinobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-amino-2-morpholinobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.