RefChem:211827
TL;DR: RefChem:211827 (CAS 68310-10-1) is a chemical compound with molecular formula C50H96N2O6 and molecular weight 820.73 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[bis(2-hydroxypropyl)amino]ethyl-(2-octadec-9-enoyloxypropyl)amino]propan-2-yl octadec-9-enoate
Also Known As: [[2-[bis amino]ethyl]imino]bis dioleate|9-Octadecenoic acid (9Z)-, [[2-[bis(2-hydroxypropyl)amino]ethyl]imino]bis(1-methyl-2,1-ethanediyl) ester|({2-[Bis(2-hydroxypropyl)amino]ethyl}azanediyl)di(propane-1,2-diyl) dioctadec-9-enoate|[[2-[bis(2-hydroxypropyl)amino]ethyl]imino]bis(1-methyl-2,1-ethanediyl) dioleate|[[2-[bis-(2-Hydroxypropyl)amino]ethyl]imino]bis(1-methyl-2,1-ethanediyl) dioleate|1,1'-(((2-(Bis(2-hydroxypropyl)amino)ethyl)imino)bis(1-methyl-2,1-ethanediyl)) di-(9Z)-9-octadecenoate|1,1'-[[[2-[Bis(2-hydroxypropyl)amino]ethyl]imino]bis(1-methyl-2,1-ethanediyl)] di-(9Z)-9-octadecenoate|1,1a(2)-[[[2-[Bis(2-hydroxypropyl)amino]ethyl]imino]bis(1-methyl-2,1-ethanediyl)] di-(9Z)-9-octadecenoate|9-Octadecenoic acid (9Z)-, ((2-(bis(2-hydroxypropyl)amino)ethyl)imino)bis(1-methyl-2,1-ethanediyl) ester|9-Octadecenoic acid (9Z)-, 1,1'-(((2-(bis(2-hydroxypropyl)amino)ethyl)imino)bis(1-methyl-2,1-ethanediyl)) ester|9-Octadecenoic acid (Z)-, [[2-[bis(2-hydroxypropyl)amino]ethyl]imino]bis(1-methyl-2,1-ethanediyl) ester|RefChem:211827|ZETNFZUQZMBACZ-UHFFFAOYSA-N
| Molecular Formula | C50H96N2O6 |
|---|---|
| Molecular Weight | 820.73 g/mol |
| LogP | 15.4 |
| Topological Polar Surface Area | 99.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 45 |
| Exact Mass | 820.72687 |
| Heavy Atoms | 58 |
| Complexity | 902.0 |
Chemical Identifiers
| CAS Number | 68310-10-1 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCC(=O)OC(C)CN(CCN(CC(C)O)CC(C)O)CC(C)OC(=O)CCCCCCCC=CCCCCCCCC |
| InChIKey | ZETNFZUQZMBACZ-UHFFFAOYSA-N |
Product Overview
RefChem:211827 (CAS 68310-10-1), with molecular formula C50H96N2O6 and molecular weight 820.73 g/mol. IUPAC: 1-[2-[bis(2-hydroxypropyl)amino]ethyl-(2-octadec-9-enoyloxypropyl)amino]propan-2-yl octadec-9-enoate.
Chemical Property Profile of RefChem:211827
Property Insights of RefChem:211827
The XLogP value of 15.4 indicates that RefChem:211827 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.5 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:211827. Following Lipinski's Rule of Five, RefChem:211827 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:211827?
The CAS number of RefChem:211827 is 68310-10-1.
What is the molecular formula of RefChem:211827?
The molecular formula of RefChem:211827 is C50H96N2O6.
What is the molecular weight of RefChem:211827?
The molecular weight of RefChem:211827 is 820.73 g/mol.
Where can I buy RefChem:211827?
You can request a quote for RefChem:211827 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:211827?
Yes, KEHONG BIO provides custom synthesis services for RefChem:211827 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.