Methyl 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate
TL;DR: Methyl 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate (CAS 500118-06-9) is a chemical compound with molecular formula C13H17NO4 and molecular weight 251.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate
Also Known As: ChemDiv2_001994, methyl 2-hydroxy-5-(4-morpholinylmethyl)benzoate, methyl 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate
| Molecular Formula | C13H17NO4 |
|---|---|
| Molecular Weight | 251.12 g/mol |
| LogP | 1.011 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.11575 |
| Heavy Atoms | 18 |
| Complexity | 426.99945 |
Chemical Identifiers
| CAS Number | 500118-06-9 |
|---|---|
| SMILES | COC(=O)C1=C(C=CC(=C1)CN2CCOCC2)O |
Product Overview
Methyl 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate (CAS 500118-06-9), with molecular formula C13H17NO4 and molecular weight 251.12 g/mol. IUPAC: methyl 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate.
Chemical Property Profile of Methyl 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate
Property Insights of Methyl 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate
The XLogP value of 1.011 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate. With a topological polar surface area (TPSA) of 59.0 Ų, Methyl 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate 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 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate?
The CAS number of Methyl 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate is 500118-06-9.
What is the molecular formula of Methyl 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate?
The molecular formula of Methyl 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate is C13H17NO4.
What is the molecular weight of Methyl 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate?
The molecular weight of Methyl 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate is 251.12 g/mol.
Where can I buy Methyl 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate?
You can request a quote for Methyl 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-hydroxy-5-(morpholin-4-ylmethyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.