2-Amino-3-methylbut-3-enoic acid
TL;DR: 2-Amino-3-methylbut-3-enoic acid (CAS 23311-86-6) is a chemical compound with molecular formula C5H9NO2 and molecular weight 115.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-3-methylbut-3-enoic acid
Also Known As: 3,4-dehydrovaline, 2-amino-3-methylbut-3-enoic acid, 3-Butenoicacid, 2-amino-3-methyl-, 3-Butenoicacid,2-amino-3-methyl, (R)-2-Amino-3-methylbut-3-enoic acid
| Molecular Formula | C5H9NO2 |
|---|---|
| Molecular Weight | 115.06 g/mol |
| LogP | -1.9 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 115.06333 |
| Heavy Atoms | 8 |
| Complexity | 120.0 |
Chemical Identifiers
| CAS Number | 23311-86-6 |
|---|---|
| SMILES | CC(=C)C(C(=O)O)N |
| InChIKey | CJNBBWGXTPGZRW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Amino-3-methylbut-3-enoic acid (CAS 23311-86-6), with molecular formula C5H9NO2 and molecular weight 115.06 g/mol. IUPAC: 2-amino-3-methylbut-3-enoic acid.
Chemical Property Profile of 2-Amino-3-methylbut-3-enoic acid
Property Insights of 2-Amino-3-methylbut-3-enoic acid
The XLogP value of -1.9 indicates that 2-Amino-3-methylbut-3-enoic acid 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-Amino-3-methylbut-3-enoic acid. Following Lipinski's Rule of Five, 2-Amino-3-methylbut-3-enoic acid 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-Amino-3-methylbut-3-enoic acid?
The CAS number of 2-Amino-3-methylbut-3-enoic acid is 23311-86-6.
What is the molecular formula of 2-Amino-3-methylbut-3-enoic acid?
The molecular formula of 2-Amino-3-methylbut-3-enoic acid is C5H9NO2.
What is the molecular weight of 2-Amino-3-methylbut-3-enoic acid?
The molecular weight of 2-Amino-3-methylbut-3-enoic acid is 115.06 g/mol.
Where can I buy 2-Amino-3-methylbut-3-enoic acid?
You can request a quote for 2-Amino-3-methylbut-3-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-3-methylbut-3-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-3-methylbut-3-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.