RefChem:168871
TL;DR: RefChem:168871 (CAS 66019-23-6) is a chemical compound with molecular formula C60H117NO9S and molecular weight 1027.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diheptadecyl 3-ethyl-2-heptadecyl-5H-1,3-oxazol-3-ium-4,4-dicarboxylate;ethyl sulfate
Also Known As: Oxazolium, 3-ethyl-2-heptadecyl-4,4-bis((heptadecyloxy)carbonyl)-4,5-dihydro-, ethyl sulfate, Oxazolium, 3-ethyl-2-heptadecyl-4,4-bis((heptadecyloxy)carbonyl)-4,5-dihydro-, ethyl sulfate (1:1), Oxazolium, 3-ethyl-2-heptadecyl-4,4-bis[(heptadecyloxy)carbonyl]-4,5-dihydro-, ethyl sulfate, Oxazolium, 3-ethyl-2-heptadecyl-4,4-bis[(heptadecyloxy)carbonyl]-4,5-dihydro-, ethyl sulfate (1:1), diheptadecyl 3-ethyl-2-heptadecyl-5H-1,3-oxazol-3-ium-4,4-dicarboxylate; ethyl sulfate
| Molecular Formula | C60H117NO9S |
|---|---|
| Molecular Weight | 1027.84 g/mol |
| LogP | 17.7601 |
| Topological Polar Surface Area | 131.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 53 |
| Exact Mass | 1027.8448 |
| Heavy Atoms | 71 |
| Complexity | 1274.3019 |
Chemical Identifiers
| CAS Number | 66019-23-6 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC1=[N+](C(CO1)(C(=O)OCCCCCCCCCCCCCCCCC)C(=O)OCCCCCCCCCCCCCCCCC)CC.CCOS(=O)(=O)[O-] |
Product Overview
RefChem:168871 (CAS 66019-23-6), with molecular formula C60H117NO9S and molecular weight 1027.84 g/mol. IUPAC: diheptadecyl 3-ethyl-2-heptadecyl-5H-1,3-oxazol-3-ium-4,4-dicarboxylate;ethyl sulfate.
Chemical Property Profile of RefChem:168871
Property Insights of RefChem:168871
The XLogP value of 17.7601 indicates that RefChem:168871 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 131.27 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:168871. Following Lipinski's Rule of Five, RefChem:168871 has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:168871?
The CAS number of RefChem:168871 is 66019-23-6.
What is the molecular formula of RefChem:168871?
The molecular formula of RefChem:168871 is C60H117NO9S.
What is the molecular weight of RefChem:168871?
The molecular weight of RefChem:168871 is 1027.84 g/mol.
Where can I buy RefChem:168871?
You can request a quote for RefChem:168871 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:168871?
Yes, KEHONG BIO provides custom synthesis services for RefChem:168871 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.