RefChem:186673
TL;DR: RefChem:186673 (CAS 67846-12-2) is a chemical compound with molecular formula C44H87N3O6S and molecular weight 785.63 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl hydrogen sulfate;(Z)-N-[2-[ethyl-[2-[[(Z)-octadec-9-enoyl]amino]ethyl]amino]ethyl]octadec-9-enamide
Also Known As: EINECS 267-357-4, Ethylbis(2-(oleoylamino)ethyl)ammonium ethyl sulphate, Ethylbis[2-(oleoylamino)ethyl]ammonium ethyl sulphate, Sulfuric acid, monoethyl ester, compd. with (9Z,9'Z)-N,N'-((ethylimino)di-2,1-ethanediyl)bis(9-octadecenamide) (1:1), Sulfuric acid, monoethyl ester, compd. with (9Z,9'Z)-N,N'-[(ethylimino)di-2,1-ethanediyl]bis[9-octadecenamide] (1:1)
| Molecular Formula | C44H87N3O6S |
|---|---|
| Molecular Weight | 785.63 g/mol |
| LogP | 11.4414 |
| Topological Polar Surface Area | 125.04 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 39 |
| Exact Mass | 785.63153 |
| Heavy Atoms | 54 |
| Complexity | 915.3694 |
Chemical Identifiers
| CAS Number | 67846-12-2 |
|---|---|
| SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)NCCN(CCNC(=O)CCCCCCC/C=C\CCCCCCCC)CC.CCOS(=O)(=O)O |
Product Overview
RefChem:186673 (CAS 67846-12-2), with molecular formula C44H87N3O6S and molecular weight 785.63 g/mol. IUPAC: ethyl hydrogen sulfate;(Z)-N-[2-[ethyl-[2-[[(Z)-octadec-9-enoyl]amino]ethyl]amino]ethyl]octadec-9-enamide.
Chemical Property Profile of RefChem:186673
Property Insights of RefChem:186673
The XLogP value of 11.4414 indicates that RefChem:186673 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.04 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:186673. Following Lipinski's Rule of Five, RefChem:186673 has 3 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 RefChem:186673?
The CAS number of RefChem:186673 is 67846-12-2.
What is the molecular formula of RefChem:186673?
The molecular formula of RefChem:186673 is C44H87N3O6S.
What is the molecular weight of RefChem:186673?
The molecular weight of RefChem:186673 is 785.63 g/mol.
Where can I buy RefChem:186673?
You can request a quote for RefChem:186673 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:186673?
Yes, KEHONG BIO provides custom synthesis services for RefChem:186673 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.