2,2-Dimethyl-beta-alanine
TL;DR: 2,2-Dimethyl-beta-alanine (CAS 19036-43-2) is a chemical compound with molecular formula C5H11NO2 and molecular weight 117.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-2,2-dimethylpropanoic acid
Also Known As: 3-amino-2,2-dimethylpropanoic acid, MeAIB, 2,2-Dimethyl-beta-alanine, 3-Aminopivalic acid, 3-Amino-2,2-dimethyl-propanoic acid
| Molecular Formula | C5H11NO2 |
|---|---|
| Molecular Weight | 117.08 g/mol |
| LogP | -2.6 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 117.07898 |
| Heavy Atoms | 8 |
| Complexity | 98.0 |
Chemical Identifiers
| CAS Number | 19036-43-2 |
|---|---|
| SMILES | CC(C)(CN)C(=O)O |
| InChIKey | DGNHGRLDBKAPEH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2-Dimethyl-beta-alanine (CAS 19036-43-2), with molecular formula C5H11NO2 and molecular weight 117.08 g/mol. IUPAC: 3-amino-2,2-dimethylpropanoic acid.
Chemical Property Profile of 2,2-Dimethyl-beta-alanine
Property Insights of 2,2-Dimethyl-beta-alanine
The XLogP value of -2.6 indicates that 2,2-Dimethyl-beta-alanine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2-Dimethyl-beta-alanine. Following Lipinski's Rule of Five, 2,2-Dimethyl-beta-alanine 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 2,2-Dimethyl-beta-alanine?
The CAS number of 2,2-Dimethyl-beta-alanine is 19036-43-2.
What is the molecular formula of 2,2-Dimethyl-beta-alanine?
The molecular formula of 2,2-Dimethyl-beta-alanine is C5H11NO2.
What is the molecular weight of 2,2-Dimethyl-beta-alanine?
The molecular weight of 2,2-Dimethyl-beta-alanine is 117.08 g/mol.
Where can I buy 2,2-Dimethyl-beta-alanine?
You can request a quote for 2,2-Dimethyl-beta-alanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Dimethyl-beta-alanine?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Dimethyl-beta-alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.