2-Bromopropionic acid, 2-octyl ester
TL;DR: 2-Bromopropionic acid, 2-octyl ester (CAS 130232-43-8) is a chemical compound with molecular formula C11H21BrO2 and molecular weight 264.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octan-2-yl 2-bromopropanoate
Also Known As: octan-2-yl 2-bromopropanoate, 2-Bromopropionic acid, 2-octyl ester, 1-Methylheptyl 2-bromopropanoate, 1-Methylheptyl 2-bromopropanoate #, Propanoic acid,2-bromo-, 1-methylheptyl ester
| Molecular Formula | C11H21BrO2 |
|---|---|
| Molecular Weight | 264.07 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 264.07248 |
| Heavy Atoms | 14 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 130232-43-8 |
|---|---|
| SMILES | CCCCCCC(C)OC(=O)C(C)Br |
| InChIKey | JRLNZNCOQCBRDL-UHFFFAOYSA-N |
Product Overview
2-Bromopropionic acid, 2-octyl ester (CAS 130232-43-8), with molecular formula C11H21BrO2 and molecular weight 264.07 g/mol. IUPAC: octan-2-yl 2-bromopropanoate.
Chemical Property Profile of 2-Bromopropionic acid, 2-octyl ester
Property Insights of 2-Bromopropionic acid, 2-octyl ester
The XLogP value of 4.6 indicates that 2-Bromopropionic acid, 2-octyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Bromopropionic acid, 2-octyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromopropionic acid, 2-octyl ester has 0 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 2-Bromopropionic acid, 2-octyl ester?
The CAS number of 2-Bromopropionic acid, 2-octyl ester is 130232-43-8.
What is the molecular formula of 2-Bromopropionic acid, 2-octyl ester?
The molecular formula of 2-Bromopropionic acid, 2-octyl ester is C11H21BrO2.
What is the molecular weight of 2-Bromopropionic acid, 2-octyl ester?
The molecular weight of 2-Bromopropionic acid, 2-octyl ester is 264.07 g/mol.
Where can I buy 2-Bromopropionic acid, 2-octyl ester?
You can request a quote for 2-Bromopropionic acid, 2-octyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromopropionic acid, 2-octyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromopropionic acid, 2-octyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.