(5R,6R)-4-bromo-5,6-dihydroxycyclohexa-1,3-dienecarboxylic acid
TL;DR: (5R,6R)-4-bromo-5,6-dihydroxycyclohexa-1,3-dienecarboxylic acid (CAS 115524-22-6) is a chemical compound with molecular formula C7H7BrO4 and molecular weight 233.95277 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5R,6R)-4-bromo-5,6-dihydroxycyclohexa-1,3-diene-1-carboxylic acid
Also Known As: 4-bromo-5,6-dihydroxycyclohexa-1,3-diene-1-carboxylic acid, (5R,6R)-4-bromo-5,6-dihydroxycyclohexa-1,3-dienecarboxylic acid, (5R,6R)-4-bromo-5,6-dihydroxycyclohexa-1,3-diene-1-carboxylic acid, (5R,6S)-4-bromo-5,6-dihydroxy-cyclohexa-1,3-diene-1-carboxylic Acid, 1,3-Cyclohexadiene-1-carboxylicacid, 4-bromo-5,6-dihydroxy-, (5R,6R)-
Technical Specifications
| Molecular Formula | C7H7BrO4 |
| Molecular Weight | 233.95277 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 233.95277 Da |
| Heavy Atoms | 12 |
| Complexity | 269.0 |
| SMILES | C1=C([C@H]([C@H](C(=C1)Br)O)O)C(=O)O |
| InChIKey | SVPDQYJPNWAGFC-RITPCOANSA-N |
Chemical Property Profile of (5R,6R)-4-bromo-5,6-dihydroxycyclohexa-1,3-dienecarboxylic acid
Property Insights of (5R,6R)-4-bromo-5,6-dihydroxycyclohexa-1,3-dienecarboxylic acid
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5R,6R)-4-bromo-5,6-dihydroxycyclohexa-1,3-dienecarboxylic acid. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (5R,6R)-4-bromo-5,6-dihydroxycyclohexa-1,3-dienecarboxylic acid. Following Lipinski's Rule of Five, (5R,6R)-4-bromo-5,6-dihydroxycyclohexa-1,3-dienecarboxylic 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
What is the CAS number of (5R,6R)-4-bromo-5,6-dihydroxycyclohexa-1,3-dienecarboxylic acid?
The CAS number of (5R,6R)-4-bromo-5,6-dihydroxycyclohexa-1,3-dienecarboxylic acid is 115524-22-6.
What is the molecular formula of (5R,6R)-4-bromo-5,6-dihydroxycyclohexa-1,3-dienecarboxylic acid?
The molecular formula of (5R,6R)-4-bromo-5,6-dihydroxycyclohexa-1,3-dienecarboxylic acid is C7H7BrO4.
What is the molecular weight of (5R,6R)-4-bromo-5,6-dihydroxycyclohexa-1,3-dienecarboxylic acid?
The molecular weight of (5R,6R)-4-bromo-5,6-dihydroxycyclohexa-1,3-dienecarboxylic acid is 233.95277 g/mol.
Where can I buy (5R,6R)-4-bromo-5,6-dihydroxycyclohexa-1,3-dienecarboxylic acid?
You can request a quote for (5R,6R)-4-bromo-5,6-dihydroxycyclohexa-1,3-dienecarboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (5R,6R)-4-bromo-5,6-dihydroxycyclohexa-1,3-dienecarboxylic acid?
Yes, CoreyChem provides custom synthesis services for (5R,6R)-4-bromo-5,6-dihydroxycyclohexa-1,3-dienecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.