6-Allylcarbamoyl-cyclohex-3-enecarboxylic acid
TL;DR: 6-Allylcarbamoyl-cyclohex-3-enecarboxylic acid (CAS 194482-48-9) is a chemical compound with molecular formula C11H15NO3 and molecular weight 209.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(prop-2-enylcarbamoyl)cyclohex-3-ene-1-carboxylic acid
Also Known As: 6-Allylcarbamoyl-cyclohex-3-enecarboxylic acid, 6-(Allylcarbamoyl)cyclohex-3-enecarboxylic acid, BAS 00447863, 6-(Allylcarbamoyl)cyclohex-3-enecarboxylicacid, 2-(Allylcarbamoyl)-4-cyclohexene-1-carboxylic acid
| Molecular Formula | C11H15NO3 |
|---|---|
| Molecular Weight | 209.11 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 209.1052 |
| Heavy Atoms | 15 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 194482-48-9 |
|---|---|
| SMILES | C=CCNC(=O)C1CC=CCC1C(=O)O |
| InChIKey | WOVNLQWKGISOPF-UHFFFAOYSA-N |
Product Overview
6-Allylcarbamoyl-cyclohex-3-enecarboxylic acid (CAS 194482-48-9), with molecular formula C11H15NO3 and molecular weight 209.11 g/mol. IUPAC: 6-(prop-2-enylcarbamoyl)cyclohex-3-ene-1-carboxylic acid.
Chemical Property Profile of 6-Allylcarbamoyl-cyclohex-3-enecarboxylic acid
Property Insights of 6-Allylcarbamoyl-cyclohex-3-enecarboxylic acid
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Allylcarbamoyl-cyclohex-3-enecarboxylic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Allylcarbamoyl-cyclohex-3-enecarboxylic acid. Following Lipinski's Rule of Five, 6-Allylcarbamoyl-cyclohex-3-enecarboxylic acid has 2 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 6-Allylcarbamoyl-cyclohex-3-enecarboxylic acid?
The CAS number of 6-Allylcarbamoyl-cyclohex-3-enecarboxylic acid is 194482-48-9.
What is the molecular formula of 6-Allylcarbamoyl-cyclohex-3-enecarboxylic acid?
The molecular formula of 6-Allylcarbamoyl-cyclohex-3-enecarboxylic acid is C11H15NO3.
What is the molecular weight of 6-Allylcarbamoyl-cyclohex-3-enecarboxylic acid?
The molecular weight of 6-Allylcarbamoyl-cyclohex-3-enecarboxylic acid is 209.11 g/mol.
Where can I buy 6-Allylcarbamoyl-cyclohex-3-enecarboxylic acid?
You can request a quote for 6-Allylcarbamoyl-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 6-Allylcarbamoyl-cyclohex-3-enecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-Allylcarbamoyl-cyclohex-3-enecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.