CID 105849
TL;DR: CID 105849 (CAS 67873-96-5) is a chemical compound with molecular formula C41H74O6 and molecular weight 662.55 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-acetyloxy-2-octadec-9-enoyloxypropyl) octadec-9-enoate
Also Known As: 1-O,2-O-Dioleoyl-3-O-acetyl-sn-glycerol, (3-acetyloxy-2-octadec-9-enoyloxypropyl) octadec-9-enoate, 9-Octadecenoic acid (9Z)-, 1-[(acetyloxy)methyl]-1,2-ethanediyl ester, 1,1 inverted exclamation marka-[1-[(Acetyloxy)methyl]-1,2-ethanediyl] di-(9Z)-9-octadecenoate
| Molecular Formula | C41H74O6 |
|---|---|
| Molecular Weight | 662.55 g/mol |
| LogP | 14.9 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 38 |
| Exact Mass | 662.5485 |
| Heavy Atoms | 47 |
| Complexity | 774.0 |
Chemical Identifiers
| CAS Number | 67873-96-5 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCC(=O)OCC(COC(=O)C)OC(=O)CCCCCCCC=CCCCCCCCC |
| InChIKey | UPZFMXRNWVDKHF-UHFFFAOYSA-N |
Product Overview
CID 105849 (CAS 67873-96-5), with molecular formula C41H74O6 and molecular weight 662.55 g/mol. IUPAC: (3-acetyloxy-2-octadec-9-enoyloxypropyl) octadec-9-enoate.
Chemical Property Profile of CID 105849
Property Insights of CID 105849
The XLogP value of 14.9 indicates that CID 105849 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for CID 105849. Following Lipinski's Rule of Five, CID 105849 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CID 105849?
The CAS number of CID 105849 is 67873-96-5.
What is the molecular formula of CID 105849?
The molecular formula of CID 105849 is C41H74O6.
What is the molecular weight of CID 105849?
The molecular weight of CID 105849 is 662.55 g/mol.
Where can I buy CID 105849?
You can request a quote for CID 105849 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CID 105849?
Yes, KEHONG BIO provides custom synthesis services for CID 105849 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.