Hexadecanoic acid, 2-chloro-1-(chloromethyl)ethyl ester
TL;DR: Hexadecanoic acid, 2-chloro-1-(chloromethyl)ethyl ester (CAS 72165-62-9) is a chemical compound with molecular formula C19H36Cl2O2 and molecular weight 366.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dichloropropan-2-yl hexadecanoate
Also Known As: 1,3-dichloropropan-2-yl hexadecanoate, 1,3-dichloropropan-2-ol palmitate, Hexadecanoic acid, 2-chloro-1-(chloromethyl)ethyl ester, J1.842.787G, Palmitic acid 1-(chloromethyl)-2-chloroethyl ester
| Molecular Formula | C19H36Cl2O2 |
|---|---|
| Molecular Weight | 366.21 g/mol |
| LogP | 8.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 18 |
| Exact Mass | 366.20923 |
| Heavy Atoms | 23 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 72165-62-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OC(CCl)CCl |
| InChIKey | LJSDIAVEHUOHLW-UHFFFAOYSA-N |
Product Overview
Hexadecanoic acid, 2-chloro-1-(chloromethyl)ethyl ester (CAS 72165-62-9), with molecular formula C19H36Cl2O2 and molecular weight 366.21 g/mol. IUPAC: 1,3-dichloropropan-2-yl hexadecanoate.
Chemical Property Profile of Hexadecanoic acid, 2-chloro-1-(chloromethyl)ethyl ester
Property Insights of Hexadecanoic acid, 2-chloro-1-(chloromethyl)ethyl ester
The XLogP value of 8.7 indicates that Hexadecanoic acid, 2-chloro-1-(chloromethyl)ethyl 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, 2-chloro-1-(chloromethyl)ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexadecanoic acid, 2-chloro-1-(chloromethyl)ethyl 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, 2-chloro-1-(chloromethyl)ethyl ester?
The CAS number of Hexadecanoic acid, 2-chloro-1-(chloromethyl)ethyl ester is 72165-62-9.
What is the molecular formula of Hexadecanoic acid, 2-chloro-1-(chloromethyl)ethyl ester?
The molecular formula of Hexadecanoic acid, 2-chloro-1-(chloromethyl)ethyl ester is C19H36Cl2O2.
What is the molecular weight of Hexadecanoic acid, 2-chloro-1-(chloromethyl)ethyl ester?
The molecular weight of Hexadecanoic acid, 2-chloro-1-(chloromethyl)ethyl ester is 366.21 g/mol.
Where can I buy Hexadecanoic acid, 2-chloro-1-(chloromethyl)ethyl ester?
You can request a quote for Hexadecanoic acid, 2-chloro-1-(chloromethyl)ethyl 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, 2-chloro-1-(chloromethyl)ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Hexadecanoic acid, 2-chloro-1-(chloromethyl)ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.