(1R,6R)-6-(Methoxycarbonyl)cyclohex-3-enecarboxylic acid
TL;DR: (1R,6R)-6-(Methoxycarbonyl)cyclohex-3-enecarboxylic acid (CAS 88335-93-7) is a chemical compound with molecular formula C9H12O4 and molecular weight 184.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,6R)-6-methoxycarbonylcyclohex-3-ene-1-carboxylic acid
Also Known As: (1R,6R)-6-(Methoxycarbonyl)cyclohex-3-enecarboxylic acid, 4-cyclohexene-1,2-dicarboxylic acid, 1-methyl ester, (1r,2r)-rel-, (1R,6R)-6-methoxycarbonylcyclohex-3-ene-1-carboxylic acid, (1R,6R)-6-(Methoxycarbonyl)cyclohex-3-ene-1-carboxylic acid, J2.983.618C
| Molecular Formula | C9H12O4 |
|---|---|
| Molecular Weight | 184.07 g/mol |
| LogP | 0.8264 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 184.07356 |
| Heavy Atoms | 13 |
| Complexity | 243.99925 |
Chemical Identifiers
| CAS Number | 88335-93-7 |
|---|---|
| SMILES | COC(=O)[C@@H]1CC=CC[C@H]1C(=O)O |
Product Overview
(1R,6R)-6-(Methoxycarbonyl)cyclohex-3-enecarboxylic acid (CAS 88335-93-7), with molecular formula C9H12O4 and molecular weight 184.07 g/mol. IUPAC: (1R,6R)-6-methoxycarbonylcyclohex-3-ene-1-carboxylic acid.
Chemical Property Profile of (1R,6R)-6-(Methoxycarbonyl)cyclohex-3-enecarboxylic acid
Property Insights of (1R,6R)-6-(Methoxycarbonyl)cyclohex-3-enecarboxylic acid
The XLogP value of 0.8264 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1R,6R)-6-(Methoxycarbonyl)cyclohex-3-enecarboxylic acid. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (1R,6R)-6-(Methoxycarbonyl)cyclohex-3-enecarboxylic acid. Following Lipinski's Rule of Five, (1R,6R)-6-(Methoxycarbonyl)cyclohex-3-enecarboxylic acid has 1 hydrogen bond donor(s) and 3 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,6R)-6-(Methoxycarbonyl)cyclohex-3-enecarboxylic acid?
The CAS number of (1R,6R)-6-(Methoxycarbonyl)cyclohex-3-enecarboxylic acid is 88335-93-7.
What is the molecular formula of (1R,6R)-6-(Methoxycarbonyl)cyclohex-3-enecarboxylic acid?
The molecular formula of (1R,6R)-6-(Methoxycarbonyl)cyclohex-3-enecarboxylic acid is C9H12O4.
What is the molecular weight of (1R,6R)-6-(Methoxycarbonyl)cyclohex-3-enecarboxylic acid?
The molecular weight of (1R,6R)-6-(Methoxycarbonyl)cyclohex-3-enecarboxylic acid is 184.07 g/mol.
Where can I buy (1R,6R)-6-(Methoxycarbonyl)cyclohex-3-enecarboxylic acid?
You can request a quote for (1R,6R)-6-(Methoxycarbonyl)cyclohex-3-enecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1R,6R)-6-(Methoxycarbonyl)cyclohex-3-enecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for (1R,6R)-6-(Methoxycarbonyl)cyclohex-3-enecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.