Einecs 269-360-6
TL;DR: Einecs 269-360-6 (CAS 68227-48-5) is a chemical compound with molecular formula C27H51NO7 and molecular weight 501.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(2-hydroxyethyl)amino]ethanol;5-(7-carboxyheptyl)-2-hexylcyclohex-3-ene-1-carboxylic acid
Also Known As: Cyclohexene compd., 5-(7-carboxyheptyl)-2-hexylcyclohex-3-ene-1-carboxylic acid- 2,2',2''-nitrilotriethanol(1:1), 5(Or 6)-carboxy-4-hexylcyclohex-2-ene-1-octanoic acid, compound with 2,2',2''-nitrilotriethanol, 5-Carboxy-4-hexylcyclohex-2-ene-1-octanoic acid, compound with 2,2',2''-nitrilotriethanol, 2-Cyclohexene-1-octanoic acid, 5(or 6)-carboxy-4-hexyl-, compd. with 2,2',2''-nitrilotris(ethanol)
| Molecular Formula | C27H51NO7 |
|---|---|
| Molecular Weight | 501.37 g/mol |
| LogP | 3.93 |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 20 |
| Exact Mass | 501.36655 |
| Heavy Atoms | 35 |
| Complexity | 472.0 |
Chemical Identifiers
| CAS Number | 68227-48-5 |
|---|---|
| SMILES | CCCCCCC1C=CC(CC1C(=O)O)CCCCCCCC(=O)O.C(CO)N(CCO)CCO |
| InChIKey | IITZECLZJWPUHA-UHFFFAOYSA-N |
Product Overview
Einecs 269-360-6 (CAS 68227-48-5), with molecular formula C27H51NO7 and molecular weight 501.37 g/mol. IUPAC: 2-[bis(2-hydroxyethyl)amino]ethanol;5-(7-carboxyheptyl)-2-hexylcyclohex-3-ene-1-carboxylic acid.
Chemical Property Profile of Einecs 269-360-6
Property Insights of Einecs 269-360-6
The XLogP value of 3.93 indicates that Einecs 269-360-6 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Einecs 269-360-6. Following Lipinski's Rule of Five, Einecs 269-360-6 has 5 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 Einecs 269-360-6?
The CAS number of Einecs 269-360-6 is 68227-48-5.
What is the molecular formula of Einecs 269-360-6?
The molecular formula of Einecs 269-360-6 is C27H51NO7.
What is the molecular weight of Einecs 269-360-6?
The molecular weight of Einecs 269-360-6 is 501.37 g/mol.
Where can I buy Einecs 269-360-6?
You can request a quote for Einecs 269-360-6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 269-360-6?
Yes, KEHONG BIO provides custom synthesis services for Einecs 269-360-6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.