(1R,3S,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid
TL;DR: (1R,3S,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid (CAS 76704-84-2) is a chemical compound with molecular formula C7H12O4 and molecular weight 160.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,3S,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid
Also Known As: 4-Amidinobenzenesulfonylfluoride, (1R,3S,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid, 3-AMINO-4,5-DIHYDROXY-CYCLOHEX-1-ENECARBOXYLATE, Cyclohexanecarboxylic acid, 3,4-dihydroxy-, (1R,3S,4S)-rel- (9CI), DHS
| Molecular Formula | C7H12O4 |
|---|---|
| Molecular Weight | 160.07 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 160.07356 |
| Heavy Atoms | 11 |
| Complexity | 157.0 |
Chemical Identifiers
| CAS Number | 76704-84-2 |
|---|---|
| SMILES | C1C[C@@H]([C@H](C[C@@H]1C(=O)O)O)O |
| InChIKey | PTPROPUVXIZJPL-SRQIZXRXSA-N |
Product Overview
(1R,3S,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid (CAS 76704-84-2), with molecular formula C7H12O4 and molecular weight 160.07 g/mol. IUPAC: (1R,3S,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid.
Chemical Property Profile of (1R,3S,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid
Property Insights of (1R,3S,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid
The XLogP value of -0.6 indicates that (1R,3S,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (1R,3S,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid. Following Lipinski's Rule of Five, (1R,3S,4S)-3,4-dihydroxycyclohexane-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
Frequently Asked Questions
What is the CAS number of (1R,3S,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid?
The CAS number of (1R,3S,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid is 76704-84-2.
What is the molecular formula of (1R,3S,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid?
The molecular formula of (1R,3S,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid is C7H12O4.
What is the molecular weight of (1R,3S,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid?
The molecular weight of (1R,3S,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid is 160.07 g/mol.
Where can I buy (1R,3S,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid?
You can request a quote for (1R,3S,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1R,3S,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for (1R,3S,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.