5-氨基-2-丁氧基苯甲酸
TL;DR: 5-氨基-2-丁氧基苯甲酸 (CAS 13737-90-1) is a chemical compound with molecular formula C11H15NO3 and molecular weight 209.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-氨基-2-丁氧基苯甲酸
5-amino-2-butoxybenzoic acid
Also Known As: 5-Amino-2-butoxybenzoic acid, BENZOIC ACID, 5-AMINO-2-BUTOXY-, 2-Butoxy-5-aminobenzoic acid, 5-amino-2-butoxy-benzoic acid, 1-(4-Amino-2-carboxyphenoxy)-butan
| Molecular Formula | C11H15NO3 |
|---|---|
| Molecular Weight | 209.11 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 72.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 209.1052 |
| Heavy Atoms | 15 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 13737-90-1 |
|---|---|
| SMILES | CCCCOC1=C(C=C(C=C1)N)C(=O)O |
| InChIKey | FOHJNOOCTRAVRJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-氨基-2-丁氧基苯甲酸 (CAS 13737-90-1), with molecular formula C11H15NO3 and molecular weight 209.11 g/mol. IUPAC: 5-amino-2-butoxybenzoic acid.
Chemical Property Profile of 5-氨基-2-丁氧基苯甲酸
Property Insights of 5-氨基-2-丁氧基苯甲酸
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-氨基-2-丁氧基苯甲酸. The TPSA of 72.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-氨基-2-丁氧基苯甲酸. Following Lipinski's Rule of Five, 5-氨基-2-丁氧基苯甲酸 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
Frequently Asked Questions
What is the CAS number of 5-氨基-2-丁氧基苯甲酸?
The CAS number of 5-氨基-2-丁氧基苯甲酸 is 13737-90-1.
What is the molecular formula of 5-氨基-2-丁氧基苯甲酸?
The molecular formula of 5-氨基-2-丁氧基苯甲酸 is C11H15NO3.
What is the molecular weight of 5-氨基-2-丁氧基苯甲酸?
The molecular weight of 5-氨基-2-丁氧基苯甲酸 is 209.11 g/mol.
Where can I buy 5-氨基-2-丁氧基苯甲酸?
You can request a quote for 5-氨基-2-丁氧基苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-氨基-2-丁氧基苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 5-氨基-2-丁氧基苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.