4-Methylhomoibotenic acid
TL;DR: 4-Methylhomoibotenic acid (CAS 77006-29-2) is a chemical compound with molecular formula C7H10N2O4 and molecular weight 186.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-3-(4-methyl-3-oxo-1,2-oxazol-5-yl)propanoic acid
Also Known As: 4-methylhomoibotenic acid, 4-Methyl-homoibotenic Acid, (R,S)-4-Methylhomoibotenic acid, (S)-4-Methylhomoibotenic acid, 2-amino-3-(4-methyl-3-oxo-1,2-oxazol-5-yl)propanoic acid
| Molecular Formula | C7H10N2O4 |
|---|---|
| Molecular Weight | 186.06 g/mol |
| LogP | -0.76928 |
| Topological Polar Surface Area | 109.32 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 186.06406 |
| Heavy Atoms | 13 |
| Complexity | 364.8146 |
Chemical Identifiers
| CAS Number | 77006-29-2 |
|---|---|
| SMILES | CC1=C(ONC1=O)CC(C(=O)O)N |
Product Overview
4-Methylhomoibotenic acid (CAS 77006-29-2), with molecular formula C7H10N2O4 and molecular weight 186.06 g/mol. IUPAC: 2-amino-3-(4-methyl-3-oxo-1,2-oxazol-5-yl)propanoic acid.
Chemical Property Profile of 4-Methylhomoibotenic acid
Property Insights of 4-Methylhomoibotenic acid
The XLogP value of -0.76928 indicates that 4-Methylhomoibotenic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 109.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methylhomoibotenic acid. Following Lipinski's Rule of Five, 4-Methylhomoibotenic acid has 3 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 4-Methylhomoibotenic acid?
The CAS number of 4-Methylhomoibotenic acid is 77006-29-2.
What is the molecular formula of 4-Methylhomoibotenic acid?
The molecular formula of 4-Methylhomoibotenic acid is C7H10N2O4.
What is the molecular weight of 4-Methylhomoibotenic acid?
The molecular weight of 4-Methylhomoibotenic acid is 186.06 g/mol.
Where can I buy 4-Methylhomoibotenic acid?
You can request a quote for 4-Methylhomoibotenic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methylhomoibotenic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Methylhomoibotenic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.