(1S,6R)-1,6-Dihydroxy-2,4-cyclohexadiene-1-carboxylic acid
TL;DR: (1S,6R)-1,6-Dihydroxy-2,4-cyclohexadiene-1-carboxylic acid (CAS 151910-11-1) is a chemical compound with molecular formula C7H8O4 and molecular weight 156.04225 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,6R)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylic acid
Also Known As: Cyclohexadiene-1,2-diol-1-carboxylic acid, (1S,6R)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylic acid, (1S,6R)-1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid, J1.686.130H, (1S,2R)-1,2-dihydroxycyclohexa-3,5-diene-1-carboxylic acid
Technical Specifications
| Molecular Formula | C7H8O4 |
| Molecular Weight | 156.04225 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.04225 Da |
| Heavy Atoms | 11 |
| Complexity | 231.0 |
| SMILES | C1=C[C@H]([C@@](C=C1)(C(=O)O)O)O |
| InChIKey | PUCYIVFXTPWJDD-VDTYLAMSSA-N |
Chemical Property Profile of (1S,6R)-1,6-Dihydroxy-2,4-cyclohexadiene-1-carboxylic acid
Property Insights of (1S,6R)-1,6-Dihydroxy-2,4-cyclohexadiene-1-carboxylic acid
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1S,6R)-1,6-Dihydroxy-2,4-cyclohexadiene-1-carboxylic acid. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (1S,6R)-1,6-Dihydroxy-2,4-cyclohexadiene-1-carboxylic acid. Following Lipinski's Rule of Five, (1S,6R)-1,6-Dihydroxy-2,4-cyclohexadiene-1-carboxylic 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 (1S,6R)-1,6-Dihydroxy-2,4-cyclohexadiene-1-carboxylic acid?
The CAS number of (1S,6R)-1,6-Dihydroxy-2,4-cyclohexadiene-1-carboxylic acid is 151910-11-1.
What is the molecular formula of (1S,6R)-1,6-Dihydroxy-2,4-cyclohexadiene-1-carboxylic acid?
The molecular formula of (1S,6R)-1,6-Dihydroxy-2,4-cyclohexadiene-1-carboxylic acid is C7H8O4.
What is the molecular weight of (1S,6R)-1,6-Dihydroxy-2,4-cyclohexadiene-1-carboxylic acid?
The molecular weight of (1S,6R)-1,6-Dihydroxy-2,4-cyclohexadiene-1-carboxylic acid is 156.04225 g/mol.
Where can I buy (1S,6R)-1,6-Dihydroxy-2,4-cyclohexadiene-1-carboxylic acid?
You can request a quote for (1S,6R)-1,6-Dihydroxy-2,4-cyclohexadiene-1-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (1S,6R)-1,6-Dihydroxy-2,4-cyclohexadiene-1-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for (1S,6R)-1,6-Dihydroxy-2,4-cyclohexadiene-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.