3-(2-Hydroxy-3-methyl-1,2lambda(5),5-oxadiazol-4-yl)acrylic acid
TL;DR: 3-(2-Hydroxy-3-methyl-1,2lambda(5),5-oxadiazol-4-yl)acrylic acid (CAS 73774-51-3) is a chemical compound with molecular formula C6H6N2O4 and molecular weight 170.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-yl)prop-2-enoic acid
Also Known As: 3-(2-Hydroxy-3-methyl-1,2lambda(5),5-oxadiazol-4-yl)acrylic acid, 2-PROPENOIC ACID, 3-(METHYLFURAZANYL)-, N-OXIDE, 2-Propenoic acid, 3-(methylfurazanyl)-, N-oxide, (E)-, 3-(4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-yl)prop-2-enoic acid, (E)-3-(4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-yl)prop-2-enoic acid
| Molecular Formula | C6H6N2O4 |
|---|---|
| Molecular Weight | 170.03 g/mol |
| LogP | -0.28578 |
| Topological Polar Surface Area | 90.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.03276 |
| Heavy Atoms | 12 |
| Complexity | 328.28912 |
Chemical Identifiers
| CAS Number | 73774-51-3 |
|---|---|
| SMILES | CC1=[N+](ON=C1/C=C/C(=O)O)[O-] |
Product Overview
3-(2-Hydroxy-3-methyl-1,2lambda(5),5-oxadiazol-4-yl)acrylic acid (CAS 73774-51-3), with molecular formula C6H6N2O4 and molecular weight 170.03 g/mol. IUPAC: (E)-3-(4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-yl)prop-2-enoic acid.
Chemical Property Profile of 3-(2-Hydroxy-3-methyl-1,2lambda(5),5-oxadiazol-4-yl)acrylic acid
Property Insights of 3-(2-Hydroxy-3-methyl-1,2lambda(5),5-oxadiazol-4-yl)acrylic acid
The XLogP value of -0.28578 indicates that 3-(2-Hydroxy-3-methyl-1,2lambda(5),5-oxadiazol-4-yl)acrylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 90.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-Hydroxy-3-methyl-1,2lambda(5),5-oxadiazol-4-yl)acrylic acid. Following Lipinski's Rule of Five, 3-(2-Hydroxy-3-methyl-1,2lambda(5),5-oxadiazol-4-yl)acrylic acid has 1 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 3-(2-Hydroxy-3-methyl-1,2lambda(5),5-oxadiazol-4-yl)acrylic acid?
The CAS number of 3-(2-Hydroxy-3-methyl-1,2lambda(5),5-oxadiazol-4-yl)acrylic acid is 73774-51-3.
What is the molecular formula of 3-(2-Hydroxy-3-methyl-1,2lambda(5),5-oxadiazol-4-yl)acrylic acid?
The molecular formula of 3-(2-Hydroxy-3-methyl-1,2lambda(5),5-oxadiazol-4-yl)acrylic acid is C6H6N2O4.
What is the molecular weight of 3-(2-Hydroxy-3-methyl-1,2lambda(5),5-oxadiazol-4-yl)acrylic acid?
The molecular weight of 3-(2-Hydroxy-3-methyl-1,2lambda(5),5-oxadiazol-4-yl)acrylic acid is 170.03 g/mol.
Where can I buy 3-(2-Hydroxy-3-methyl-1,2lambda(5),5-oxadiazol-4-yl)acrylic acid?
You can request a quote for 3-(2-Hydroxy-3-methyl-1,2lambda(5),5-oxadiazol-4-yl)acrylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Hydroxy-3-methyl-1,2lambda(5),5-oxadiazol-4-yl)acrylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Hydroxy-3-methyl-1,2lambda(5),5-oxadiazol-4-yl)acrylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.