Methyl 4-aminobenzoate
TL;DR: Methyl 4-aminobenzoate (CAS 619-45-4) is a chemical compound with molecular formula C8H9NO2 and molecular weight 151.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-aminobenzoate
Also Known As: Methyl 4-aminobenzoate, 4-Aminobenzoic acid methyl ester, METHYL P-AMINOBENZOATE, 4-Carbomethoxyaniline, 4-(Methoxycarbonyl)aniline
| Molecular Formula | C8H9NO2 |
|---|---|
| Molecular Weight | 151.06 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 151.06332 |
| Heavy Atoms | 11 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 619-45-4 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)N |
| InChIKey | LZXXNPOYQCLXRS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 4-aminobenzoate (CAS 619-45-4), with molecular formula C8H9NO2 and molecular weight 151.06 g/mol. IUPAC: methyl 4-aminobenzoate.
Chemical Property Profile of Methyl 4-aminobenzoate
Property Insights of Methyl 4-aminobenzoate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-aminobenzoate. With a topological polar surface area (TPSA) of 52.3 Ų, Methyl 4-aminobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-aminobenzoate has 1 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 Methyl 4-aminobenzoate?
The CAS number of Methyl 4-aminobenzoate is 619-45-4.
What is the molecular formula of Methyl 4-aminobenzoate?
The molecular formula of Methyl 4-aminobenzoate is C8H9NO2.
What is the molecular weight of Methyl 4-aminobenzoate?
The molecular weight of Methyl 4-aminobenzoate is 151.06 g/mol.
Where can I buy Methyl 4-aminobenzoate?
You can request a quote for Methyl 4-aminobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-aminobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-aminobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.