3-Chloropropane-1,2-diol dipalmitate
TL;DR: 3-Chloropropane-1,2-diol dipalmitate (CAS 1246815-94-0) is a chemical compound with molecular formula C35H67ClO4 and molecular weight 586.4728 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-chloro-2-hexadecanoyloxypropyl) hexadecanoate
Also Known As: rac 1,2-Bis-palmitol-3-chloropropanediol, 3-Chloropropane-1,2-diol dipalmitate, rac 1,2-Bis-palmitoyl-3-chloropropanediol, 3-Chloropropane-1,2-diyl dipalmitate, (3-chloro-2-hexadecanoyloxypropyl) hexadecanoate
Technical Specifications
| Molecular Formula | C35H67ClO4 |
| Molecular Weight | 586.4728 g/mol |
| XLogP | 15.3 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 34 |
| Exact Mass | 586.4728 Da |
| Heavy Atoms | 40 |
| Complexity | 539.0 |
| SMILES | CCCCCCCCCCCCCCCC(=O)OCC(CCl)OC(=O)CCCCCCCCCCCCCCC |
| InChIKey | MQWXVGSHNINWHB-UHFFFAOYSA-N |
Chemical Property Profile of 3-Chloropropane-1,2-diol dipalmitate
Property Insights of 3-Chloropropane-1,2-diol dipalmitate
The XLogP value of 15.3 indicates that 3-Chloropropane-1,2-diol dipalmitate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 3-Chloropropane-1,2-diol dipalmitate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloropropane-1,2-diol dipalmitate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 3-Chloropropane-1,2-diol dipalmitate?
The CAS number of 3-Chloropropane-1,2-diol dipalmitate is 1246815-94-0.
What is the molecular formula of 3-Chloropropane-1,2-diol dipalmitate?
The molecular formula of 3-Chloropropane-1,2-diol dipalmitate is C35H67ClO4.
What is the molecular weight of 3-Chloropropane-1,2-diol dipalmitate?
The molecular weight of 3-Chloropropane-1,2-diol dipalmitate is 586.4728 g/mol.
Where can I buy 3-Chloropropane-1,2-diol dipalmitate?
You can request a quote for 3-Chloropropane-1,2-diol dipalmitate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Chloropropane-1,2-diol dipalmitate?
Yes, CoreyChem provides custom synthesis services for 3-Chloropropane-1,2-diol dipalmitate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.