Alpha-(4-isobutyl(cyclohexen-1-yl))propionic acid
TL;DR: Alpha-(4-isobutyl(cyclohexen-1-yl))propionic acid (CAS 33844-77-8) is a chemical compound with molecular formula C13H22O2 and molecular weight 210.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2-methylpropyl)cyclohexen-1-yl]propanoic acid
Also Known As: 1623 SE, 1623-SE, 2-[4-(2-methylpropyl)cyclohex-1-en-1-yl]propanoic acid, S-1623, 2-[4-(2-methylpropyl)cyclohexen-1-yl]propanoic acid
| Molecular Formula | C13H22O2 |
|---|---|
| Molecular Weight | 210.16 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 210.16199 |
| Heavy Atoms | 15 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 33844-77-8 |
|---|---|
| SMILES | CC(C)CC1CCC(=CC1)C(C)C(=O)O |
| InChIKey | RYDOMJHOQPXWJQ-UHFFFAOYSA-N |
Product Overview
Alpha-(4-isobutyl(cyclohexen-1-yl))propionic acid (CAS 33844-77-8), with molecular formula C13H22O2 and molecular weight 210.16 g/mol. IUPAC: 2-[4-(2-methylpropyl)cyclohexen-1-yl]propanoic acid.
Chemical Property Profile of Alpha-(4-isobutyl(cyclohexen-1-yl))propionic acid
Property Insights of Alpha-(4-isobutyl(cyclohexen-1-yl))propionic acid
The XLogP value of 3.6 indicates that Alpha-(4-isobutyl(cyclohexen-1-yl))propionic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Alpha-(4-isobutyl(cyclohexen-1-yl))propionic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Alpha-(4-isobutyl(cyclohexen-1-yl))propionic acid has 1 hydrogen bond donor(s) and 2 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 Alpha-(4-isobutyl(cyclohexen-1-yl))propionic acid?
The CAS number of Alpha-(4-isobutyl(cyclohexen-1-yl))propionic acid is 33844-77-8.
What is the molecular formula of Alpha-(4-isobutyl(cyclohexen-1-yl))propionic acid?
The molecular formula of Alpha-(4-isobutyl(cyclohexen-1-yl))propionic acid is C13H22O2.
What is the molecular weight of Alpha-(4-isobutyl(cyclohexen-1-yl))propionic acid?
The molecular weight of Alpha-(4-isobutyl(cyclohexen-1-yl))propionic acid is 210.16 g/mol.
Where can I buy Alpha-(4-isobutyl(cyclohexen-1-yl))propionic acid?
You can request a quote for Alpha-(4-isobutyl(cyclohexen-1-yl))propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alpha-(4-isobutyl(cyclohexen-1-yl))propionic acid?
Yes, KEHONG BIO provides custom synthesis services for Alpha-(4-isobutyl(cyclohexen-1-yl))propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.