1,2-Dihexylcyclopropene-3-carboxylic acid
TL;DR: 1,2-Dihexylcyclopropene-3-carboxylic acid (CAS 54467-87-7) is a chemical compound with molecular formula C16H28O2 and molecular weight 252.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dihexylcycloprop-2-ene-1-carboxylic acid
Also Known As: 1,2-Dihexylcyclopropene-3-carboxylic acid, 2,3-dihexylcycloprop-2-ene-1-carboxylic acid, 2,3-Dihexyl-2-cyclopropene-1-carboxylic acid, 2,3-Dihexyl-2-cyclopropene-1-carboxylic acid #, 2-Cyclopropene-1-carboxylic acid, 2,3-dihexyl-
| Molecular Formula | C16H28O2 |
|---|---|
| Molecular Weight | 252.21 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 252.20892 |
| Heavy Atoms | 18 |
| Complexity | 269.0 |
Chemical Identifiers
| CAS Number | 54467-87-7 |
|---|---|
| SMILES | CCCCCCC1=C(C1C(=O)O)CCCCCC |
| InChIKey | HIZHTBNZCIJIHX-UHFFFAOYSA-N |
Product Overview
1,2-Dihexylcyclopropene-3-carboxylic acid (CAS 54467-87-7), with molecular formula C16H28O2 and molecular weight 252.21 g/mol. IUPAC: 2,3-dihexylcycloprop-2-ene-1-carboxylic acid.
Chemical Property Profile of 1,2-Dihexylcyclopropene-3-carboxylic acid
Property Insights of 1,2-Dihexylcyclopropene-3-carboxylic acid
The XLogP value of 5.4 indicates that 1,2-Dihexylcyclopropene-3-carboxylic 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, 1,2-Dihexylcyclopropene-3-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Dihexylcyclopropene-3-carboxylic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,2-Dihexylcyclopropene-3-carboxylic acid?
The CAS number of 1,2-Dihexylcyclopropene-3-carboxylic acid is 54467-87-7.
What is the molecular formula of 1,2-Dihexylcyclopropene-3-carboxylic acid?
The molecular formula of 1,2-Dihexylcyclopropene-3-carboxylic acid is C16H28O2.
What is the molecular weight of 1,2-Dihexylcyclopropene-3-carboxylic acid?
The molecular weight of 1,2-Dihexylcyclopropene-3-carboxylic acid is 252.21 g/mol.
Where can I buy 1,2-Dihexylcyclopropene-3-carboxylic acid?
You can request a quote for 1,2-Dihexylcyclopropene-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dihexylcyclopropene-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dihexylcyclopropene-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.