Β-脲基异丁酸
TL;DR: Β-脲基异丁酸 (CAS 2905-86-4) is a chemical compound with molecular formula C5H10N2O3 and molecular weight 146.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Β-脲基异丁酸
3-(carbamoylamino)-2-methylpropanoic acid
Also Known As: beta-Ureidoisobutyric acid, beta-Uba, 3-Ureidoisobutyrate, 2-Methyl-3-ureidopropanoic acid, 3-ureidoisobutyric acid
| Molecular Formula | C5H10N2O3 |
|---|---|
| Molecular Weight | 146.07 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 92.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 146.06914 |
| Heavy Atoms | 10 |
| Complexity | 146.0 |
Chemical Identifiers
| CAS Number | 2905-86-4 |
|---|---|
| SMILES | CC(CNC(=O)N)C(=O)O |
| InChIKey | PHENTZNALBMCQD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Β-脲基异丁酸 (CAS 2905-86-4), with molecular formula C5H10N2O3 and molecular weight 146.07 g/mol. IUPAC: 3-(carbamoylamino)-2-methylpropanoic acid.
Chemical Property Profile of Β-脲基异丁酸
Property Insights of Β-脲基异丁酸
The XLogP value of -1.0 indicates that Β-脲基异丁酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Β-脲基异丁酸. Following Lipinski's Rule of Five, Β-脲基异丁酸 has 3 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 Β-脲基异丁酸?
The CAS number of Β-脲基异丁酸 is 2905-86-4.
What is the molecular formula of Β-脲基异丁酸?
The molecular formula of Β-脲基异丁酸 is C5H10N2O3.
What is the molecular weight of Β-脲基异丁酸?
The molecular weight of Β-脲基异丁酸 is 146.07 g/mol.
Where can I buy Β-脲基异丁酸?
You can request a quote for Β-脲基异丁酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Β-脲基异丁酸?
Yes, KEHONG BIO provides custom synthesis services for Β-脲基异丁酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.