Methyl 3-amino-4-hydroxybenzoate
TL;DR: Methyl 3-amino-4-hydroxybenzoate (CAS 536-25-4) is a chemical compound with molecular formula C8H9NO3 and molecular weight 167.05824 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-amino-4-hydroxybenzoate
Also Known As: Methyl 3-amino-4-hydroxybenzoate, Orthocaine, Orthoform, Aminobenz, Orthoderm
Application Areas
Top 5 of 13 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H9NO3 |
| Molecular Weight | 167.05824 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 72.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 167.05824 Da |
| Heavy Atoms | 12 |
| Complexity | 172.0 |
| SMILES | COC(=O)C1=CC(=C(C=C1)O)N |
| InChIKey | VNQABZCSYCTZMS-UHFFFAOYSA-N |
Product Description
Applications: Methyl 3-amino-4-hydroxybenzoate is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A pharmaceutical intermediate supplied by CoreyChem, Methyl 3-amino-4-hydroxybenzoate (CAS 536-25-4) has the molecular formula C8H9NO3 and a molecular weight of 167.06 g/mol. Synonyms include Methyl 3-amino-4-hydroxybenzoate and Orthocaine.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Methyl 3-amino-4-hydroxybenzoate
Property Insights of Methyl 3-amino-4-hydroxybenzoate
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-amino-4-hydroxybenzoate. The TPSA of 72.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-amino-4-hydroxybenzoate. Following Lipinski's Rule of Five, Methyl 3-amino-4-hydroxybenzoate has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methyl 3-amino-4-hydroxybenzoate?
The CAS number of Methyl 3-amino-4-hydroxybenzoate is 536-25-4.
What is the molecular formula of Methyl 3-amino-4-hydroxybenzoate?
The molecular formula of Methyl 3-amino-4-hydroxybenzoate is C8H9NO3.
What is the molecular weight of Methyl 3-amino-4-hydroxybenzoate?
The molecular weight of Methyl 3-amino-4-hydroxybenzoate is 167.05824 g/mol.
What are the applications of Methyl 3-amino-4-hydroxybenzoate?
Methyl 3-amino-4-hydroxybenzoate is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog...
Where can I buy Methyl 3-amino-4-hydroxybenzoate?
You can request a quote for Methyl 3-amino-4-hydroxybenzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 3-amino-4-hydroxybenzoate?
Yes, CoreyChem provides custom synthesis services for Methyl 3-amino-4-hydroxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.