![3-(1-Carboxyethenoxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid structure](/static/products/6141/61414-76-4.webp)
3-(1-Carboxyethenoxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid
TL;DR: 3-(1-Carboxyethenoxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid (CAS 61414-76-4) is a chemical compound with molecular formula C10H10O7 and molecular weight 242.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1-carboxyethenoxy)-5-hydroxy-7-oxabicyclo[4.1.0]hept-2-ene-2-carboxylic acid
Also Known As: CHORISMIC ACID,6-EPOXIDE DERIV, .alpha.-5,6-Epoxide of chorismic acid, 3-(1-carboxyethenoxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid, 4-[(1-Carboxyethen-1-yl)oxy]-5-hydroxy-7-oxabicyclo[4.1.0]hept-2-ene-2-carboxylic acid, 2-hydroxy-3-(3-hydroxy-3-oxoprop-1-en-2-yl)oxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid
| Molecular Formula | C10H10O7 |
|---|---|
| Molecular Weight | 242.04 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 242.04265 |
| Heavy Atoms | 17 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 61414-76-4 |
|---|---|
| SMILES | C=C(C(=O)O)OC1C=C(C2C(C1O)O2)C(=O)O |
| InChIKey | IHJFDKMNEAKDBN-UHFFFAOYSA-N |
Product Overview
3-(1-Carboxyethenoxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid (CAS 61414-76-4), with molecular formula C10H10O7 and molecular weight 242.04 g/mol. IUPAC: 4-(1-carboxyethenoxy)-5-hydroxy-7-oxabicyclo[4.1.0]hept-2-ene-2-carboxylic acid.
Chemical Property Profile of 3-(1-Carboxyethenoxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid
Property Insights of 3-(1-Carboxyethenoxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid
The XLogP value of -0.8 indicates that 3-(1-Carboxyethenoxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1-Carboxyethenoxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid. Following Lipinski's Rule of Five, 3-(1-Carboxyethenoxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid has 3 hydrogen bond donor(s) and 7 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-(1-Carboxyethenoxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid?
The CAS number of 3-(1-Carboxyethenoxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid is 61414-76-4.
What is the molecular formula of 3-(1-Carboxyethenoxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid?
The molecular formula of 3-(1-Carboxyethenoxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid is C10H10O7.
What is the molecular weight of 3-(1-Carboxyethenoxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid?
The molecular weight of 3-(1-Carboxyethenoxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid is 242.04 g/mol.
Where can I buy 3-(1-Carboxyethenoxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid?
You can request a quote for 3-(1-Carboxyethenoxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1-Carboxyethenoxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(1-Carboxyethenoxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-ene-5-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.