Phosphoric acid, monoisooctyl ester, compd. with 2,2'-iminobis(ethanol) (1:?)
TL;DR: Phosphoric acid, monoisooctyl ester, compd. with 2,2'-iminobis(ethanol) (1:?) (CAS 68379-10-2) is a chemical compound with molecular formula C12H30NO6P and molecular weight 315.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-hydroxyethylamino)ethanol;6-methylheptyl dihydrogen phosphate
Also Known As: benzyl(1-chloro-2,2,2-trifluoroethyl)carbamate, Phosphoric acid, monoisooctyl ester, compd. with 2,2'-iminobis(ethanol), 6-methylheptyl dihydrogen phosphate- 2,2'-iminodiethanol(1:1), Isooctyl dihydrogen phosphate, compound with 2,2'-iminodiethanol, Phosphoric acid, monoisooctyl ester, compd. with 2,2'-iminobis[ethanol]
| Molecular Formula | C12H30NO6P |
|---|---|
| Molecular Weight | 315.18 g/mol |
| LogP | 0.87 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 315.18106 |
| Heavy Atoms | 20 |
| Complexity | 192.0 |
Chemical Identifiers
| CAS Number | 68379-10-2 |
|---|---|
| SMILES | CC(C)CCCCCOP(=O)(O)O.C(CO)NCCO |
| InChIKey | LHXNIRPCJJXWTD-UHFFFAOYSA-N |
Product Overview
Phosphoric acid, monoisooctyl ester, compd. with 2,2'-iminobis(ethanol) (1:?) (CAS 68379-10-2), with molecular formula C12H30NO6P and molecular weight 315.18 g/mol. IUPAC: 2-(2-hydroxyethylamino)ethanol;6-methylheptyl dihydrogen phosphate.
Chemical Property Profile of Phosphoric acid, monoisooctyl ester, compd. with 2,2'-iminobis(ethanol) (1:?)
Property Insights of Phosphoric acid, monoisooctyl ester, compd. with 2,2'-iminobis(ethanol) (1:?)
The XLogP value of 0.87 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphoric acid, monoisooctyl ester, compd. with 2,2'-iminobis(ethanol) (1:?). The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphoric acid, monoisooctyl ester, compd. with 2,2'-iminobis(ethanol) (1:?). Following Lipinski's Rule of Five, Phosphoric acid, monoisooctyl ester, compd. with 2,2'-iminobis(ethanol) (1:?) has 5 hydrogen bond donor(s) and 7 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, monoisooctyl ester, compd. with 2,2'-iminobis(ethanol) (1:?)?
The CAS number of Phosphoric acid, monoisooctyl ester, compd. with 2,2'-iminobis(ethanol) (1:?) is 68379-10-2.
What is the molecular formula of Phosphoric acid, monoisooctyl ester, compd. with 2,2'-iminobis(ethanol) (1:?)?
The molecular formula of Phosphoric acid, monoisooctyl ester, compd. with 2,2'-iminobis(ethanol) (1:?) is C12H30NO6P.
What is the molecular weight of Phosphoric acid, monoisooctyl ester, compd. with 2,2'-iminobis(ethanol) (1:?)?
The molecular weight of Phosphoric acid, monoisooctyl ester, compd. with 2,2'-iminobis(ethanol) (1:?) is 315.18 g/mol.
Where can I buy Phosphoric acid, monoisooctyl ester, compd. with 2,2'-iminobis(ethanol) (1:?)?
You can request a quote for Phosphoric acid, monoisooctyl ester, compd. with 2,2'-iminobis(ethanol) (1:?) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphoric acid, monoisooctyl ester, compd. with 2,2'-iminobis(ethanol) (1:?)?
Yes, KEHONG BIO provides custom synthesis services for Phosphoric acid, monoisooctyl ester, compd. with 2,2'-iminobis(ethanol) (1:?) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.