Hexadecanoic acid, (3-bromoprop-2-ynyl) ester
TL;DR: Hexadecanoic acid, (3-bromoprop-2-ynyl) ester (CAS 157336-02-2) is a chemical compound with molecular formula C19H33BrO2 and molecular weight 372.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromoprop-2-ynyl hexadecanoate
Also Known As: 3-Bromo-2-propynyl palmitate, 3-Bromo-2-propynyl palmitate #, 3-bromoprop-2-ynyl hexadecanoate, 3-Bromoprop-2-yn-1-yl hexadecanoate, Hexadecanoic acid, (3-bromoprop-2-ynyl) ester
| Molecular Formula | C19H33BrO2 |
|---|---|
| Molecular Weight | 372.17 g/mol |
| LogP | 8.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 16 |
| Exact Mass | 372.16638 |
| Heavy Atoms | 22 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 157336-02-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OCC#CBr |
| InChIKey | JQBJDBDGJKFQAH-UHFFFAOYSA-N |
Product Overview
Hexadecanoic acid, (3-bromoprop-2-ynyl) ester (CAS 157336-02-2), with molecular formula C19H33BrO2 and molecular weight 372.17 g/mol. IUPAC: 3-bromoprop-2-ynyl hexadecanoate.
Chemical Property Profile of Hexadecanoic acid, (3-bromoprop-2-ynyl) ester
Property Insights of Hexadecanoic acid, (3-bromoprop-2-ynyl) ester
The XLogP value of 8.6 indicates that Hexadecanoic acid, (3-bromoprop-2-ynyl) 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, Hexadecanoic acid, (3-bromoprop-2-ynyl) ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexadecanoic acid, (3-bromoprop-2-ynyl) ester has 0 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 Hexadecanoic acid, (3-bromoprop-2-ynyl) ester?
The CAS number of Hexadecanoic acid, (3-bromoprop-2-ynyl) ester is 157336-02-2.
What is the molecular formula of Hexadecanoic acid, (3-bromoprop-2-ynyl) ester?
The molecular formula of Hexadecanoic acid, (3-bromoprop-2-ynyl) ester is C19H33BrO2.
What is the molecular weight of Hexadecanoic acid, (3-bromoprop-2-ynyl) ester?
The molecular weight of Hexadecanoic acid, (3-bromoprop-2-ynyl) ester is 372.17 g/mol.
Where can I buy Hexadecanoic acid, (3-bromoprop-2-ynyl) ester?
You can request a quote for Hexadecanoic acid, (3-bromoprop-2-ynyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexadecanoic acid, (3-bromoprop-2-ynyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Hexadecanoic acid, (3-bromoprop-2-ynyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.