Phosphoric acid, isooctyl ester, compd. with 2,2',2''-nitrilotris(ethanol)
TL;DR: Phosphoric acid, isooctyl ester, compd. with 2,2',2''-nitrilotris(ethanol) (CAS 73070-49-2) is a chemical compound with molecular formula C14H34NO7P and molecular weight 359.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(2-hydroxyethyl)amino]ethanol;6-methylheptyl dihydrogen phosphate
Also Known As: Isooctyl alcohol, phosphate, triethanolamine salt, Ethanol, 2,2',2''-nitrilotris-, compd. with isooctyl phosphate, Phosphoric acid, isooctyl ester, compd. with 2,2',2''-nitrilotris(ethanol), Phosphoric acid, isooctyl ester, compd. with 2,2',2''-nitrilotris[ethanol], 2-[bis(2-hydroxyethyl)amino]ethanol; 6-methylheptyl dihydrogen phosphate
| Molecular Formula | C14H34NO7P |
|---|---|
| Molecular Weight | 359.21 g/mol |
| LogP | 0.5774 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 13 |
| Exact Mass | 359.20728 |
| Heavy Atoms | 23 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 73070-49-2 |
|---|---|
| SMILES | CC(C)CCCCCOP(=O)(O)O.C(CO)N(CCO)CCO |
| InChIKey | JGTSZKLXBDGLNY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phosphoric acid, isooctyl ester, compd. with 2,2',2''-nitrilotris(ethanol) (CAS 73070-49-2), with molecular formula C14H34NO7P and molecular weight 359.21 g/mol. IUPAC: 2-[bis(2-hydroxyethyl)amino]ethanol;6-methylheptyl dihydrogen phosphate.
Chemical Property Profile of Phosphoric acid, isooctyl ester, compd. with 2,2',2''-nitrilotris(ethanol)
Property Insights of Phosphoric acid, isooctyl ester, compd. with 2,2',2''-nitrilotris(ethanol)
The XLogP value of 0.5774 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphoric acid, isooctyl ester, compd. with 2,2',2''-nitrilotris(ethanol). The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphoric acid, isooctyl ester, compd. with 2,2',2''-nitrilotris(ethanol). Following Lipinski's Rule of Five, Phosphoric acid, isooctyl ester, compd. with 2,2',2''-nitrilotris(ethanol) has 5 hydrogen bond donor(s) and 8 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 Phosphoric acid, isooctyl ester, compd. with 2,2',2''-nitrilotris(ethanol)?
The CAS number of Phosphoric acid, isooctyl ester, compd. with 2,2',2''-nitrilotris(ethanol) is 73070-49-2.
What is the molecular formula of Phosphoric acid, isooctyl ester, compd. with 2,2',2''-nitrilotris(ethanol)?
The molecular formula of Phosphoric acid, isooctyl ester, compd. with 2,2',2''-nitrilotris(ethanol) is C14H34NO7P.
What is the molecular weight of Phosphoric acid, isooctyl ester, compd. with 2,2',2''-nitrilotris(ethanol)?
The molecular weight of Phosphoric acid, isooctyl ester, compd. with 2,2',2''-nitrilotris(ethanol) is 359.21 g/mol.
Where can I buy Phosphoric acid, isooctyl ester, compd. with 2,2',2''-nitrilotris(ethanol)?
You can request a quote for Phosphoric acid, isooctyl ester, compd. with 2,2',2''-nitrilotris(ethanol) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphoric acid, isooctyl ester, compd. with 2,2',2''-nitrilotris(ethanol)?
Yes, KEHONG BIO provides custom synthesis services for Phosphoric acid, isooctyl ester, compd. with 2,2',2''-nitrilotris(ethanol) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.