Ethanethiol, 2,2'-iminobis-, bis(dihydrogen phosphate) (ester), tetrahydrate
TL;DR: Ethanethiol, 2,2'-iminobis-, bis(dihydrogen phosphate) (ester), tetrahydrate (CAS 122413-80-3) is a chemical compound with molecular formula C4H13NO6P2S2 and molecular weight 296.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-phosphonosulfanylethylamino)ethylsulfanylphosphonic acid
Also Known As: Bis(2-thiophosphatoethyl)amine tetrahydrate, 2,2'-Iminobisethanethiol bis(dihydrogen phosphate) tetrahydrate, Phosphorothioic acid, S,S'-iminodiethylene ester, tetrahydrate, Ethanethiol, 2,2'-iminobis-, bis(dihydrogen phosphate) (ester), tetrahydrate, 2-(2-phosphonosulfanylethylamino)ethylsulfanylphosphonic acid
| Molecular Formula | C4H13NO6P2S2 |
|---|---|
| Molecular Weight | 296.97 g/mol |
| LogP | 0.2278 |
| Topological Polar Surface Area | 127.09 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 296.96594 |
| Heavy Atoms | 15 |
| Complexity | 237.85751 |
Chemical Identifiers
| CAS Number | 122413-80-3 |
|---|---|
| SMILES | C(CSP(=O)(O)O)NCCSP(=O)(O)O |
Product Overview
Ethanethiol, 2,2'-iminobis-, bis(dihydrogen phosphate) (ester), tetrahydrate (CAS 122413-80-3), with molecular formula C4H13NO6P2S2 and molecular weight 296.97 g/mol. IUPAC: 2-(2-phosphonosulfanylethylamino)ethylsulfanylphosphonic acid.
Chemical Property Profile of Ethanethiol, 2,2'-iminobis-, bis(dihydrogen phosphate) (ester), tetrahydrate
Property Insights of Ethanethiol, 2,2'-iminobis-, bis(dihydrogen phosphate) (ester), tetrahydrate
The XLogP value of 0.2278 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanethiol, 2,2'-iminobis-, bis(dihydrogen phosphate) (ester), tetrahydrate. The TPSA of 127.09 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanethiol, 2,2'-iminobis-, bis(dihydrogen phosphate) (ester), tetrahydrate. Following Lipinski's Rule of Five, Ethanethiol, 2,2'-iminobis-, bis(dihydrogen phosphate) (ester), tetrahydrate has 5 hydrogen bond donor(s) and 5 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 Ethanethiol, 2,2'-iminobis-, bis(dihydrogen phosphate) (ester), tetrahydrate?
The CAS number of Ethanethiol, 2,2'-iminobis-, bis(dihydrogen phosphate) (ester), tetrahydrate is 122413-80-3.
What is the molecular formula of Ethanethiol, 2,2'-iminobis-, bis(dihydrogen phosphate) (ester), tetrahydrate?
The molecular formula of Ethanethiol, 2,2'-iminobis-, bis(dihydrogen phosphate) (ester), tetrahydrate is C4H13NO6P2S2.
What is the molecular weight of Ethanethiol, 2,2'-iminobis-, bis(dihydrogen phosphate) (ester), tetrahydrate?
The molecular weight of Ethanethiol, 2,2'-iminobis-, bis(dihydrogen phosphate) (ester), tetrahydrate is 296.97 g/mol.
Where can I buy Ethanethiol, 2,2'-iminobis-, bis(dihydrogen phosphate) (ester), tetrahydrate?
You can request a quote for Ethanethiol, 2,2'-iminobis-, bis(dihydrogen phosphate) (ester), tetrahydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanethiol, 2,2'-iminobis-, bis(dihydrogen phosphate) (ester), tetrahydrate?
Yes, KEHONG BIO provides custom synthesis services for Ethanethiol, 2,2'-iminobis-, bis(dihydrogen phosphate) (ester), tetrahydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.