6-(Pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid
TL;DR: 6-(Pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid (CAS 355830-81-8) is a chemical compound with molecular formula C12H17NO3 and molecular weight 223.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid
Also Known As: 6-(Pyrrolidine-1-carbonyl)-cyclohex-3-enecarboxylic acid, 6-(pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid, 6-(pyrrolidine-1-carbonyl)cyclohex-3-enecarboxylic acid, BAS 03650854, 6-(pyrrolidin-1-ylcarbonyl)cyclohex-3-ene-1-carboxylic acid
| Molecular Formula | C12H17NO3 |
|---|---|
| Molecular Weight | 223.12 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 223.12085 |
| Heavy Atoms | 16 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 355830-81-8 |
|---|---|
| SMILES | C1CCN(C1)C(=O)C2CC=CCC2C(=O)O |
| InChIKey | MFFWEFPNGDBSLN-UHFFFAOYSA-N |
Product Overview
6-(Pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid (CAS 355830-81-8), with molecular formula C12H17NO3 and molecular weight 223.12 g/mol. IUPAC: 6-(pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid.
Chemical Property Profile of 6-(Pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid
Property Insights of 6-(Pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(Pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid. With a topological polar surface area (TPSA) of 57.6 Ų, 6-(Pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(Pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylic 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 6-(Pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid?
The CAS number of 6-(Pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid is 355830-81-8.
What is the molecular formula of 6-(Pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid?
The molecular formula of 6-(Pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid is C12H17NO3.
What is the molecular weight of 6-(Pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid?
The molecular weight of 6-(Pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid is 223.12 g/mol.
Where can I buy 6-(Pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid?
You can request a quote for 6-(Pyrrolidine-1-carbonyl)cyclohex-3-ene-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 6-(Pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-(Pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.