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4-Methoxybicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid
TL;DR: 4-Methoxybicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid (CAS 20923-55-1) is a chemical compound with molecular formula C10H10O3 and molecular weight 178.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7-carboxylic acid
Also Known As: 2-cyano-2-phenylhydrazonoglyoxalic acid amide, Bicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid, 4-methoxy-, 4-METHOXYBICYCLO[4.2.0]OCTA-1,3,5-TRIENE-7-CARBOXYLIC ACID, 4-methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7-carboxylic acid, 3-methoxybicyclo[4.2.0]octa-2,4,9-triene-8-carboxylic Acid
| Molecular Formula | C10H10O3 |
|---|---|
| Molecular Weight | 178.06 g/mol |
| LogP | 1.4195 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 178.06299 |
| Heavy Atoms | 13 |
| Complexity | 357.18753 |
Chemical Identifiers
| CAS Number | 20923-55-1 |
|---|---|
| SMILES | COC1=CC2=C(CC2C(=O)O)C=C1 |
Product Overview
4-Methoxybicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid (CAS 20923-55-1), with molecular formula C10H10O3 and molecular weight 178.06 g/mol. IUPAC: 4-methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7-carboxylic acid.
Chemical Property Profile of 4-Methoxybicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid
Property Insights of 4-Methoxybicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid
The XLogP value of 1.4195 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxybicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid. With a topological polar surface area (TPSA) of 46.53 Ų, 4-Methoxybicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methoxybicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid has 1 hydrogen bond donor(s) and 2 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-Methoxybicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid?
The CAS number of 4-Methoxybicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid is 20923-55-1.
What is the molecular formula of 4-Methoxybicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid?
The molecular formula of 4-Methoxybicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid is C10H10O3.
What is the molecular weight of 4-Methoxybicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid?
The molecular weight of 4-Methoxybicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid is 178.06 g/mol.
Where can I buy 4-Methoxybicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid?
You can request a quote for 4-Methoxybicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxybicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxybicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.