Einecs 249-902-8
TL;DR: Einecs 249-902-8 (CAS 90604-95-8) is a chemical compound with molecular formula C12H25NO7 and molecular weight 295.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(2-hydroxyethyl)amino]ethanol;hexanedioic acid
Also Known As: triethanolamine adipate, EINECS 249-902-8, Adipic acid, triethanolamine polymer, (C6-H15-N-O3.C6-H10-O4)x-, Adipic acid, compound with 2,2',2''-nitrilotriethanol
| Molecular Formula | C12H25NO7 |
|---|---|
| Molecular Weight | 295.16 g/mol |
| LogP | -1.0187 |
| Topological Polar Surface Area | 138.53 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 295.16312 |
| Heavy Atoms | 20 |
| Complexity | 217.69568 |
Chemical Identifiers
| CAS Number | 90604-95-8 |
|---|---|
| SMILES | C(CCC(=O)O)CC(=O)O.C(CO)N(CCO)CCO |
Product Overview
Einecs 249-902-8 (CAS 90604-95-8), with molecular formula C12H25NO7 and molecular weight 295.16 g/mol. IUPAC: 2-[bis(2-hydroxyethyl)amino]ethanol;hexanedioic acid.
Chemical Property Profile of Einecs 249-902-8
Property Insights of Einecs 249-902-8
The XLogP value of -1.0187 indicates that Einecs 249-902-8 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 138.53 Ų falls within the moderate polarity range, balancing permeability and solubility for Einecs 249-902-8. Following Lipinski's Rule of Five, Einecs 249-902-8 has 5 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Einecs 249-902-8?
The CAS number of Einecs 249-902-8 is 90604-95-8.
What is the molecular formula of Einecs 249-902-8?
The molecular formula of Einecs 249-902-8 is C12H25NO7.
What is the molecular weight of Einecs 249-902-8?
The molecular weight of Einecs 249-902-8 is 295.16 g/mol.
Where can I buy Einecs 249-902-8?
You can request a quote for Einecs 249-902-8 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 249-902-8?
Yes, KEHONG BIO provides custom synthesis services for Einecs 249-902-8 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.