4-(2-氨基苯基)丁酸
TL;DR: 4-(2-氨基苯基)丁酸 (CAS 56182-28-6) is a chemical compound with molecular formula C10H13NO2 and molecular weight 179.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-氨基苯基)丁酸
4-(2-aminophenyl)butanoic acid
Also Known As: 4-(2-aminophenyl)butanoic acid, 4-(2-Aminophenyl)butyric acid, 2-aminoBenzenebutanoic acid, NCIStruc1_000925, NCIStruc2_000356
| Molecular Formula | C10H13NO2 |
|---|---|
| Molecular Weight | 179.09 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 179.09464 |
| Heavy Atoms | 13 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 56182-28-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CCCC(=O)O)N |
| InChIKey | FEJUPMPORLHXGG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(2-氨基苯基)丁酸 (CAS 56182-28-6), with molecular formula C10H13NO2 and molecular weight 179.09 g/mol. IUPAC: 4-(2-aminophenyl)butanoic acid.
Chemical Property Profile of 4-(2-氨基苯基)丁酸
Property Insights of 4-(2-氨基苯基)丁酸
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-氨基苯基)丁酸. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-氨基苯基)丁酸. Following Lipinski's Rule of Five, 4-(2-氨基苯基)丁酸 has 2 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 4-(2-氨基苯基)丁酸?
The CAS number of 4-(2-氨基苯基)丁酸 is 56182-28-6.
What is the molecular formula of 4-(2-氨基苯基)丁酸?
The molecular formula of 4-(2-氨基苯基)丁酸 is C10H13NO2.
What is the molecular weight of 4-(2-氨基苯基)丁酸?
The molecular weight of 4-(2-氨基苯基)丁酸 is 179.09 g/mol.
Where can I buy 4-(2-氨基苯基)丁酸?
You can request a quote for 4-(2-氨基苯基)丁酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-氨基苯基)丁酸?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-氨基苯基)丁酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.